Supplementary Material (ESI) for Chemical Society Reviews This journal is (c) The Royal Society of Chemistry 2007 Djukic.structures.txt Version 30th Jan. 2007 SEARCH TERMS ------------ Search terms used where a searchable electronic version of the original publication was available: {whole word} ABRREVIATIONS ------------- IDENTIFICATION Refcode - CCDC reference code. Where no CCDC refcode was available, a unique ad-hoc code was made either from the refocde of the enantiomer or by combining 'Lit Ref' and 'Lit Compd#'. Enantiomer/Diastermer ent-XXXX - the opposite enantiomer of XXXX epr-XXXX - the enantiopure compound corresponding to racemate XXXX rac-XXXX - the racemate of XXXX Lit-Compd# - the identification of the compound used in the publication 'Lit Ref' NUMERICAL DATA CIF - Source of numerical data in CIF format D - CCDC deposited data with archive # 'CCDC' J - Supplementary material with journal publication 'Lit Ref' N - No CIF available for the structure determination Q - Stereochemical CIF produced by ConQuest of CSD Z - No structure analysis undertaken CCDC - Archive number of data deposited with the CCDC JSM - Supplementary material from journal N/Y Not available/Available respectively Lit Ref - Numerical literature reference referring to table REFERENCES ENANTIOPURITY Enantio excess - numerical value of ee or a character code B - Bulk X - Crystal a - molecule is achiral er - enantiopure reference group in the compound - i.e. absolute configuration determination by internal reference. je - judged enantiopure rac - judged to be a racemate mes - a meso compound OR - specific rotation of the optical activity either as a signed numerical value or a character code N - specific rotation not reported CD - measurement of circular dichroism spectrum in solution or solid B - solution CD spectrum of bulk N - CD spectrum not reported X - solution CD spectrum of crystal EC - enantioselective chromatography N - no measurements reported Y - measurements reported with numerical values CRYSTAL STRUCTURE S - CA / NC / NA means centrosymmetric achiral / non-centrosymmetric chiral / non-centrosymmetric achiral respectively P - number of directions in which the origin can not be fixed by relation to a symmetry element SPG - space group type number as used in International Tables Volume A Z' - number of molecules in the asymmetric unit of the unit cell Vol Cell - volume of the cell in A**3 rounded to nearest integer DIFFRACTION DATA Instr - the type of measuring instrument or diffractometer CAD4 - Enraf-Nonius CAD4 diffractometer/ CAD4F/CAD4-T DP1030 - Nonius DIP-1030H IPDS2 - Stoe IPDS2 Imaging plate diffractometer KAPCCD - Nonius Kappa CCD diffractometer MAR345 - MAR345 diffractometer with imaging plate detector PW1100 - Philips PW1100 4-circle diffractometer P4 - Syntex P4 4-circle diffractometer RAXIIC - MSC/Rigaku RAXIS IIC imaging-plate diffractometer RAXIV - Rigaku RAXIS-IV imaging-plate diffractometer SMART - Bruker SMART-CCD diffractometer STADI4 - Stoe STADI4 4-circle diffractometer Data Redn - data reduction software or method BIOTEX - Product of Rigaku CARESS - Unreferenced product DENCOL - DENZO and COLLECT (a product of Nonius - Hooft, R.W.W., 1998) DENZO - Otwinowski & Minor, 1997 HELENA - Software from A. L . Spek molen - Product of Nonius - Fair (1990) PLATON - Software of A.L. Spek raxis - Product of Rigaku Corp. SAINT - Product of Siemens-Brukker Scala - W. Kabsch (1993) J. Appl. Cryst., 21, 67-72 SHLXTL - SHELXTL, the commercial (Brukker) version of G. M. Sheldrick teXsan - Crystal Structure Analysis Package - Molecular Structure Corporation. X-RED - Software from Stoe xtal37 - xtal 3.7 a product of the University of Western Australia Absorp Corr - absorption correction software or procedure ABSCOR - Higashi, T., ABSCOR: an Empirical Absorption Correction Based on Fourier Coefficient Fitting. Rigaku Corporation, Tokyo, 1995 analyt - an analytical absorption correction was applied. cylind - a cylindrical absorption correction was applied. DIFABS - in PLATON, Spek (2003) empirl - an unspecified semi-empirical absorption correction was applied. eSHLXP - the semi-empirical SHELXTL-PLUS absorption correction was applied. muscan - the absorption correction "multi-scan" was applied none - no aborption correction applied NORTH - A. C. T. North, D. C. Phillips and F. S. Mathews (1968) Acta Cryst. A24, 351-359 phiscn - Unreferenced procedure refdlf - the absorption correction refdelf (Walker_&_Stuart,_1983) Acta Cryst.,A39, 158-166. SADABS - R. H. Blessing (1995). Acta Cryst. A51, 33-38 or perhaps G. M. Sheldrick, Bruker AXS Inc. SDA210 - SADABS V2.10 (Sheldrick, G.M.,2003) teXsan - Crystal Structure Analysis Package - Molecular Structure Corporation. unspec - an unspecified absorption correction procedure was applied Rescat - Resonant scattering contribution calculated according to the formula of Girard et al. Frdl diff - Resonant scattering contribution for an entirely non-centrosymmetric structure calculated according to Flack & Shmueli. Frdl diff cntro - Resonant scattering contribution for a partially centrosymmetric structure calculated according to Flack & Shmueli. Frdl Covr - Percentage of Friedel pairs measured. Abs Struc - Flack parameter for non-centrosymmetric structures. checkCIF/PLATON Synx errs - Number of syntax errors in the CIF Alrt A, B, C, G, 1, 2, 3, 4, 5 - Numbers of the different types of alerts of checkCIf A, B, C, D & E and alerts of PLATON 1, 2, 3, 4 & 5. PLT FIT - Platon percentage fit to a space group of higher symmetry STATUS SDT Crystal-structure determination: (1) not undertaken; (0) undertaken. XRP Crystallographic data and reporting is: (1) unsatisfactory; (0) satisfactory. Data and reporting may be unsatisfactory if (i) Friedel coverage is less than 30%, (ii) No complete Flack parameter x(u) is reported, (iii) no CIF with experimental data is available, (iv) important checkCIF or PLATON alerts have not been attended to, (v) significant fit to higher symmetry space- group not mentionned, (vi) OOY Structure determination is: (1) candidate for ORTEP-of-the-year; (0) not a candidate. CRP Physico-chemical characterization (enantiopurity) of products (reactants) is: (1) unsatisfactory; (0) satisfactory. CIP CIP chirality indicators are: (1) incorrect; (0) correct. CXD Crystal and chemical data are: (1) incompatible; (0) compatible or indeterminate. Incompatible means (i) the enantiopurity from the physico-chemical measurements and the Flack parameter do not correspond. CRYSTAL STRUCTURES ------------------ | IDENTIFICATION | NUM DATA | ENANTIOPURITY | CRYSTAL STRUCTURE | DIFFRACTION DATA | checkCIF/PLATON | STATUS | Refcode Enantiomer Lit CIF CCDC JSM Lit Enantio OR CD EC S P SPG Z' Vol Instr Data Absorp Refcode Re- Frdl Frdl Frdl Abs CIF Synx Alrt Alrt Alrt Alrt Alrt Alrt Alrt Alrt Alrt PLT| Crystal | Chemical|Both| Diastermer Compd# Ref excess Cell Redn Corr scat diff diff Covr Struc errs A B C G 1 2 3 4 5 FIT SDT XRP OOY CRP CIP CXD B X cntro ADAFUG ss2e3e D 177672 N 072 er er -1683 B N NC 1 4 1 1740 RAXIV teXsan ? ADAFUG 332 365 365 54 0.448(18) D 0 25 4 19 4 26 18 4 4 0 - 0 1 0 0 1 1 ADAFUG01 ss2e1e D 177671 N 072 er er -1681 B N NC 1 4 1 1738 RAXIV teXsan ? ADAFUG01 332 365 365 0 0.10(3) D 0 22 4 21 4 27 14 3 7 0 - 0 1 0 0 1 1 ATOTOS 3b D 224295 Y 008 er er N N N NC 0 19 1 2006 MAR345 ? phiscn ATOTOS 1321 1171 1171 63 0.00(33) D 0 18 5 94 12 23 14 10 82 0 - 0 1 0 1 0 0 BAZQUO01 9a J none Y 053 je je N N N NC 0 92 1/2 4635 SMART SAINT SADABS BAZQUO01 388 328 328 69 -0.004(13) J 0 9 1 39 9 17 3 6 32 0 - 0 0 0 1 0 0 BAZREZ01 40 J none Y 053 je je N N N NC 0 96 1/2 4817 P4 CARESS empirl BAZREZ01 384 339 339 71 -0.03(2) J 0 9 1 46 10 19 5 6 36 0 - 0 0 0 1 0 0 CEJBAV 3a D 275460 N 030 er er -3029 N N NC 0 19 1 3161 RAXIV raxis muscan CEJBAV 274 328 328 72 0.49(3) D 0 6 1 12 3 9 8 2 3 0 - 0 1 0 0 0 1 CEHZUL 4b D 275459 N 030 er er +1529 N N NC 1 4 1 1656 RAXIV raxis none CEHZUL 270 331 331 72 0.63(2) D 0 5 0 9 5 12 3 1 3 0 - 0 1 0 0 0 1 DAFPAC 2 D 224572 N 078 rac rac N N N NC 1 4 1 1738 DP1030 Scala refdlf DAFPAC 188 242 242 77 0.30(8) D 0 10 5 26 2 12 16 5 10 0 93 0 1 1 0 0 0 DAFPEG 3 D 224573 N 078 rac rac N N N CA 0 15 1 8458 DP1030 Scala refdlf DAFPEG 177 239 0 - - D 0 14 0 20 1 16 1 5 13 0 0 0 0 0 0 0 FINYOR Sp-7b J none Y 018 >95 >95 -551 N N NC 1 4 1 2927 KAPCCD DENCOL SDA210 FINYOR 264 301 301 100 0.03(2) J 0 5 0 24 2 9 2 1 19 0 - 0 0 0 0 0 0 GAXWUX ent-GAXZEK +3 Q none N 002 er er +3461 N N NC 0 19 1 1769 RAXIIC ? ABSCOR GAXWUX 301 302 302 59 0.50(2) Q 0 0 0 0 2 2 0 0 0 0 - 0 1 0 0 0 1 GAXZEK ent-GAXWUX -3 Q none N 002 er er -3458 N N NC 0 19 1 1774 RAXIIC ? ABSCOR GAXZEK 301 302 302 61 0.61(3) Q 0 0 0 0 2 2 0 0 0 0 - 0 1 0 0 0 1 GAXZIO ent-GAXZOU -3solv Q none N 002 er er -2885 N N NC 1 4 2 1928 RAXIIC ? ABSCOR GAXZIO 295 302 302 47 0.40(2) Q 0 3 0 0 4 4 2 0 0 0 - 0 1 0 0 0 1 GAXZOU ent-GAXZIO +3solv Q none N 002 er er +2888 N N NC 1 4 2 1932 RAXIIC ? ABSCOR GAXZOU 295 302 302 47 0.45(3) Q 0 3 1 2 4 4 5 1 0 0 - 0 1 0 0 0 1 GEYQUW01 RSSR-4 D 100989 N 001 er er +2685 N N NC 1 4 1 1894 RAXIIC BIOTEX ABSCOR GEYQUW01 299 305 305 61 0.59(2) D 7 21 14 191 13 26 30 8 175 0 - 0 0 0 0 0 1 GEYRUX01 RSSS-4 D 117015 N 001 er er -2880 N N NC 1 4 1 1881 RAXIIC BIOTEX ABSCOR GEYRUX01 299 305 305 55 0.42(3) D 6 18 3 74 13 26 22 8 52 0 - 0 0 0 0 0 1 GITSAD epr-GITSEH 4 Q none Y 017 er er N N N NC 1 4 1 1065 SMART SAINT eSHLXP GITSAD 1318 1180 1180 100 -0.010(10) Q 0 0 0 2 0 0 1 1 0 0 - 0 1 0 1 0 0 GITSEH rac-GITSAD 3 Q none Y 017 rac rac N N N CA 0 148 1 8995 SMART SAINT eSHLXP GITSEH 1320 1173 0 - - Q 0 0 0 3 0 0 0 3 0 0 - 0 1 0 1 0 0 GOCFUZ ent-GOCGAG RpS-4 J none Y 006 er er +682 N N NC 0 19 1 1793 RAXIIC BIOTEX ABSCOR GOCFUZ 568 682 682 55 0.440(8) J 0 19 1 33 11 25 8 6 25 0 - 0 1 0 0 0 1 GOCGAG ent-GOCFUZ SpR-4 J none Y 006 er er -681 N N NC 0 19 1 1788 RAXIIC BIOTEX ABSCOR GOCGAG 568 682 682 63 0.409(12) J 0 19 0 34 11 25 8 6 25 0 - 0 1 0 0 0 1 GOCGEK SRRS-5 J 118027 Y 006 er er -3507 N N NC 1 4 1 1927 RAXIIC BIOTEX ABSCOR GOCGEK 566 684 684 70 0.641(6) J 0 25 18 68 13 26 39 7 52 0 - 0 0 0 0 0 1 GOCGEKnt ent-GOCGEK RSSR-5 Z 006 er +3511 N N GOCGEKnt Z 1 0 0 0 0 0 GOCGIO ent-GOCGOU RRRR-5 J 118028 Y 006 er er +2353 N N NC 0 19 1 4846 RAXIIC BIOTEX ABSCOR GOCGIO 554 694 694 65 0.490(12) J 0 20 10 90 13 26 29 8 70 0 - 0 1 0 0 0 1 GOCGOU ent-GOCGIO SSSS-5 J 118029 Y 006 er er -2359 N N NC 0 19 1 4867 RAXIIC BIOTEX ABSCOR GOCGOU 554 694 694 64 0.579(8) J 0 24 7 102 14 27 34 12 74 0 - 0 1 0 0 0 1 HAKLOV 2 J 245754 Y 052 er er 5meas N Y NC 1 169 1 5685 ? ? ? HAKLOV 275 375 375 100 -0.01(2) J 0 22 1 27 2 25 5 3 19 0 - 0 1 0 0 0 0 HAPCOQ RpS5al Q none N 007 er er +1237 N N NC 0 19 2 8661 RAXIIC ? ABSCOR HAPCOQ 268 340 340 ? ? Q 0 67 18 82 1 1 100 67 0 0 - 0 1 0 0 JPD 0 HAPFEJ SSRS7w Q none N 007 er er -545 N N NC 1 4 2 4316 RAXIIC ? ABSCOR HAPFEJ 266 341 341 ? ? Q 0 3 1 6 6 6 9 1 0 0 - 0 1 1 0 JPD 0 HORPEJ SSSS4s D 117014 N 001 er er -900 N N NC 1 5 2 8115 RAXIIC BIOTEX ABSCOR HORPEJ 296 303 303 17 0.42(2) D 5 32 53 197 18 45 143 9 103 0 - 0 1 0 0 0 1 IDASUC 16 D 299669 Y 031 er er -486 N N NC 0 19 1 3849 KAPCCD DENZO cylind IDASUC 365 380 380 72 -0.01(3) D 0 1 1 44 3 5 2 2 40 0 - 0 0 0 0 0 0 INEVEC 8a D 228271 Y 064 rac rac N N N CA 0 14 1 2048 KAPCCD ? refdlf INEVEC 271 292 0 - - D 0 7 0 6 2 8 3 3 1 0 - 0 1 0 0 0 0 INEVIG 8b D 228272 Y 064 rac rac N N N CA 0 15 1 4790 KAPCCD ? refdlf INEVIG 268 296 0 - - D 0 8 0 12 2 9 4 8 1 0 - 0 1 0 0 1 0 INEVOM u8c D 228273 Y 064 rac rac N N N CA 0 14 1 2857 KAPCCD ? refdlf INEVOM 263 293 0 - - D 0 7 5 13 2 9 14 3 1 0 - 0 1 1 1 0 0 INEVUS 7Ru8d D 228274 Y 064 er er +550 N N NC 0 19 1 2675 KAPCCD ? refdlf INEVUS 275 304 304 1 0.03(3) D 0 8 0 11 4 8 9 3 3 0 - 0 1 0 0 0 0 INEWUT ent-INEXAA actpR5 D 228275 Y 064 >96 >96 +751 B Y NC 1 4 1 1108 KAPCCD ? refdlf INEWUT 263 287 287 56 -0.01(3) D 0 2 0 11 3 5 3 2 6 0 - 0 1 0 0 0 0 INEXAA ent-INEWUT actsS5 D 228276 Y 064 >96 >96 -733 B Y NC 1 4 1 1109 KAPCCD ? refdlf INEXAA 263 287 287 45 0.01(4) D 0 2 1 7 3 6 0 1 6 0 - 0 1 0 0 0 0 JANDIM u-5 J 233013 Y 027 rac rac N N N CA 0 2 1 1203 KAPCCD ? refdlf JANDIM 232 259 0 - - J 0 7 1 14 5 13 4 5 5 0 - 0 1 0 0 0 0 JANDIMp+ epr+JANDIM +u5 Z 027 82 +493 B N JANDIMp+ Z 1 0 0 0 0 0 JANDIMp- epr-JANDIM -u5 Z 027 89 -545 B N JANDIMp- Z 1 0 0 0 0 0 JANDOS 6 J 257930 Y 027 rac rac N N N CA 0 14 1 1812 KAPCCD ? refdlf JANDOS 218 232 0 - - J 0 7 2 7 3 10 3 4 2 0 - 0 1 0 0 0 0 JANDUY 6-HgCl J 257931 Y 027 rac rac N N N CA 0 2 1/2 1257 KAPCCD ? refdlf JANDUY 1271 1427 0 - - J 0 7 0 7 1 9 2 2 2 0 - 0 1 0 0 0 0 JANFAG u-9 J 233014 Y 027 rac rac N N N NC 0 19 1 2192 KAPCCD ? refdlf JANFAG 240 263 263 0/100 0.45(4) J 0 2 6 52 2 56 2 0 4 0 - 0 1 0 0 0 0 JANFEK 10 J 257932 Y 027 rac rac N N N CA 0 2 1/2 1504 KAPCCD ? refdlf JANFEK 1211 1444 0 - - J 0 7 1 16 2 14 3 5 4 0 - 0 1 0 0 0 0 JANFIO epr-MIXKEJ (pS)-1 J 233012 Y 027 je je -68 X N NC 1 4 1 719 KAPCCD ? refdlf JANFIO 1461 1180 1180 54 0.00(1) J 0 2 0 12 2 11 2 0 3 0 - 0 1 0 0 0 0 JANFIOnt ent-JANFIO +1 Z 027 je +46 X N JANFIOnt Z 1 0 0 0 0 0 JUXQEY 3 D 102704 N 003 er er -64 N N NC 0 19 2 6539 RAXIIC BIOTEX ABSCOR JUXQEY 267 317 317 77 0.411(9) D 0 20 13 106 11 25 39 6 80 0 - 0 1 1 0 0 1 JUXQIC 4 D 102705 N 003 er er -50 N N NC 0 19 2 6371 RAXIIC BIOTEX ABSCOR JUXQIC 539 702 702 39 0.566(9) D 0 23 36 129 11 26 93 8 72 0 - 0 1 0 0 0 1 JUXQOI ent-JUXQUO RpS-5 Q none N 003 er er +159 N N NC 0 19 1 3868 RAXIIC ? ABSCOR JUXQOI 266 341 341 ? ? Q 0 0 0 1 1 1 0 0 4 0 - 0 1 0 0 0 1 JUXQUO ent-JUXQOI SpR-5 D 102706 N 003 er er -158 N N NC 0 19 1 3860 RAXIIC ? ABSCOR JUXQUO 266 341 341 60 0.59(2) D 0 29 1 58 10 37 8 6 47 0 - 0 1 0 0 0 1 JUXSUQ SpR-6 Q none N 003 er er -59 N N NC 0 19 1 3894 RAXIIC ? ? JUXSUQ 514 708 708 ? ? Q 0 0 2 1 1 1 0 1 0 0 - 0 1 0 0 0 1 JUXTOL 6 D 102707 N 003 er er +339 N N NC 0 19 1 4445 RAXIIC BIOTEX ABSCOR JUXTOL 511 708 708 64 0.397(5) D 0 19 2 62 10 26 12 6 49 0 - 0 1 0 0 0 1 KEHXUQ Rp4b Q none N 066 je je +658 B N NC 0 19 1 1783 RAXIV teXsan teXsan KEHXUQ 1455 1168 1168 0 .043/.058 Q 0 0 1 1 1 2 0 1 0 0 - 0 1 0 0 0 0 LENCOW 1 Q none N 005 er er +65 N N NC 1 4 1 898 CAD4 ? none LENCOW 301 450 450 0 0.01(4) Q 0 0 1 0 1 1 0 1 0 0 - 0 1 0 0 1 0 LENGEQ 7a Q none N 005 er er +194 N N NC 1 4 1 1558 CAD4 ? none LENGEQ 281 330 330 0 0.04(6) Q 0 0 1 1 0 0 0 LISRAG 6a D 128866 N 020 er er +728 B N NC 0 19 1 2953 KAPCCD ? none LISRAG 251 380 380 0 -0.00(3) D 0 10 0 7 4 12 3 3 3 0 - 0 0 0 0 1 0 LISREK 8 D 128867 N 020 rac rac N N N CA 0 14 1 3149 CAD4 molen psiscn LISREK 235 353 0 - - D 0 13 4 13 5 23 4 3 5 0 - 0 1 0 0 0 0 LISRIO 15 D 128868 N 020 er er -299 B N NC 0 19 1 2493 KAPCCD ? none LISRIO 230 377 377 100 0.01(2) D 0 11 5 5 4 15 6 2 2 0 - 0 1 0 0 1 0 MIXKEJ rac-JANFIO 1b Q none Y 026 rac rac N N N CA 0 2 1 708 KAPCCD ? ? MIXKEJ 1461 1180 0 - - Q 0 0 0 2 0 0 1 1 0 0 - 0 1 0 0 0 0 MIXKIN 1c Q none Y 026 rac rac N N N CA 0 15 1/2 2556 KAPCCD ? ? MIXKIN 1377 1339 0 - - Q 0 0 0 1 0 0 0 0 1 0 - 0 1 0 0 0 0 MIXKOT rac-QAGHUC 1i Q none Y 026 rac rac N N N CA 0 14 1 2179 KAPCCD ? ? MIXKOT 254 270 0 - - Q 0 0 0 2 0 0 2 0 0 0 - 0 1 0 0 0 0 MIXKUZ 1j Q none Y 026 a a N N N CA 0 2 2 2841 KAPCCD ? ? MIXKUZ 261 295 0 - - Q 0 0 0 0 0 0 0 0 0 0 - 0 1 0 0 0 0 MAXYIU fIrpmb J 291434 Y 088 rac rac N N N CA 0 14 1 3927 SMART SAINT none MAXYIU 1192 1334 0 - - J 0 11 0 5 0 10 3 2 1 0 - 0 0 0 0 0 0 MAXYOA mIrpmb J 291435 Y 088 rac rac N N N CA 0 14 1 3271 SMART SAINT none MAXYOA 1282 1234 0 - - J 0 9 0 7 0 10 4 1 1 0 - 0 0 0 0 0 0 MAXYUG fIrflz J 291436 Y 088 rac rac N N N CA 0 14 1 4389 SMART SAINT none MAXYUG 1247 1301 0 - - J 0 10 1 4 0 11 1 1 2 0 - 0 0 0 0 0 0 NAHCAB fLIrL J 247244 Y 090 er er N B N NC 0 18 1 6930 IPDS2 X-RED DIFABS NAHCAB 1167 1401 1401 78 -0.003(7) J 0 2 1 29 11 13 21 5 4 0 - 0 0 0 0 0 0 NOGWIP +5EtOH Q none Y 004 er er +29 N N NC 1 5 1 3754 RAXIIC ? ABSCOR NOGWIP 269 333 333 100 ? Q 0 0 0 5 4 4 3 2 0 0 - 0 1 0 0 0 0 NOGWOV -6 Q none Y 004 er er -291 N N NC 0 19 1 3466 RAXIIC ? ABSCOR NOGWOV 269 333 333 100 ? Q 0 1 1 3 4 4 3 1 1 0 - 0 1 0 0 0 0 OBOMEY 3 D 183904 Y 099 rac rac N N N CA 0 2 1 2663 SMART ? SADABS OBOMEY 174 240 0 - - D 0 6 2 16 3 10 11 3 3 0 - 1 0 0 0 0 0 OBOMIC 4a D 232518 Y 099 rac rac N N N CA 0 2 1 2448 SMART ? SADABS OBOMIC 174 247 0 - - D 0 2 1 12 3 6 3 5 4 0 - 0 0 0 0 0 0 OBOMOI 5a D 232519 Y 099 rac rac N N N CA 0 14 1 4905 SMART ? SADABS OBOMOI 176 247 0 - - D 0 6 2 16 3 10 11 3 3 0 - 0 1 0 0 0 0 OBOMUO 6 D 232520 Y 099 rac rac N N N CA 0 2 1 1638 SMART ? SADABS OBOMUO 191 240 0 - - D 0 4 3 10 1 7 2 7 2 0 - 0 0 0 0 0 0 PAXZIY 3b D 266417 N 029 rac rac N N N CA 0 14 1 3629 SMART SAINT SADABS PAXZIY 267 289 0 - - D 0 4 1 14 0 11 2 0 6 0 - 0 1 0 1 1 0 PAXZOE 4a D 266418 N 029 rac rac N N N CA 0 14 1 3670 CAD4 PLATON NORTH PAXZOE 296 353 0 - - D 0 11 3 27 1 6 14 7 15 0 - 0 1 0 0 1 0 PAXZUK 4b D 266419 N 029 rac rac N N N CA 0 14 1 3697 CAD4 PLATON NORTH PAXZUK 267 289 0 - - D 0 10 3 29 2 7 11 10 16 0 - 0 1 0 0 1 0 QAGHIQ ent-QAGHOW 5b J 198824 Y 028 er er N N N NC 1 4 1 2140 KAPCCD ? refdlf QAGHIQ 269 294 294 0 0.03(4) J 0 8 5 20 5 21 7 6 4 0 96 0 1 0 0 0 0 QAGHIQ01 ent-QAGHOW 7S8e J 198824 Y 064 er er N B N NC 1 4 2 2140 KAPCCD ? refdlf QAGHIQ01 269 294 294 0 0.03(4) J 0 8 5 20 5 21 7 6 4 0 96 0 1 0 0 0 0 QAGHOW ent-QAGHIQ 5c J 198825 Y 028 er er N N N NC 1 4 1 2141 KAPCCD ? refdlf QAGHOW 269 294 294 0 0.01(2) J 0 8 3 22 5 14 15 4 5 0 96 0 1 0 0 0 0 QAGHOW01 ent-QAGHIQ 7R8e J 198825 Y 064 er er N N N NC 1 4 2 2141 KAPCCD ? refdlf QAGHOW01 269 294 294 0 0.01(2) J 0 8 3 22 5 14 15 4 5 0 96 0 1 0 0 0 0 QAGHUC ent-QAGJAK pR3 J 198826 Y 028 >96 er +751 B N NC 1 4 1 1128 KAPCCD ? refdlf QAGHUC 254 270 270 0 -0.04(5) J 0 9 2 36 6 12 12 7 22 0 - 0 1 0 0 0 0 QAGHUC01 ent-QAGJAK pR5 J 198826 Y 064 >96 >96 +751 B Y NC 1 4 1 1128 KAPCCD ? refdlf QAGHUC01 254 270 270 100 -0.04(5) J 0 9 2 36 6 12 12 7 22 0 - 0 1 0 0 0 0 QAGJAK ent-QAGHUC pS3 J 198827 Y 028 >96 er -733 B N NC 0 19 1 2150 KAPCCD ? refdlf QAGJAK 254 270 270 77 -0.05(5) J 0 7 2 9 3 8 7 3 3 0 - 0 0 0 0 0 0 QAGJAK01 ent-QAGHUC pS5 J 198827 Y 064 >96 >96 -733 B Y NC 0 19 1 2150 KAPCCD ? refdlf QAGJAK01 254 270 270 77 -0.05(5) J 0 7 2 9 3 8 7 3 3 0 - 0 0 0 0 0 0 QOJPAG ent-QOJPEK RpRc-3 D 160656 N 009 er er +493 N N NC 1 4 1 1132 RAXIV ? ABSCOR QOJPAG 1435 1227 1227 0 0.11(2) D 0 14 6 39 10 22 11 8 28 0 - 0 1 0 0 0 1 QOJPEK ent-QOJPAG SpSc-3 D 160657 N 009 er er -494 N N NC 1 4 1 1131 RAXIV ? ABSCOR QOJPEK 1435 1227 1227 6 0.36(2) D 0 16 4 12 5 16 8 7 6 0 - 0 1 0 0 0 1 QOJPIO ent-QOJPOU SpRc-3 D 160658 N 009 er er -661 N N NC 0 19 1 2285 RAXIV ? ABSCOR QOJPIO 1435 1227 1227 0 0.187(19) D 0 11 5 15 5 16 13 5 2 0 - 0 1 0 0 0 1 QOJPOU ent-QOJPIO RpSc-3 D 160659 N 009 er er +660 N N NC 0 19 1 2297 RAXIV ? ABSCOR QOJPOU 1435 1227 1227 62 0.47(2) D 0 15 2 36 12 22 10 7 26 0 - 0 1 0 0 0 1 QOMXAR ent-SIXLEQ SS3b D 151430 N 094 je je +106 N Y NC 1 4 1 833 CAD4-T HELENA refdlf QOMXAR 1411 1018 1018 0 0.017(11) D 0 10 0 4 3 10 1 4 2 0 - 0 1 0 0 0 0 RALVUW 4a D 259660 N 034 er er +463 N N NC 0 197 1/2 16540 SMART SHLXTL SADABS RALVUW 299 295 295 87 -0.02(4) D 0 7 6 33 3 12 14 3 20 0 - 0 1 0 0 0 0 RIFFAN 2 Q none Y 024 rac rac N N N CA 0 2 1 1038 CAD4F ? psiscn RIFFAN 272 385 0 - - Q 0 0 0 0 0 0 0 0 0 0 - 0 1 0 0 0 0 RIFFER 6a Q none Y 024 mes mes N N N CA 0 14 1 2701 CAD4F ? psiscn RIFFER 289 392 0 - - Q 0 0 0 1 0 0 0 1 0 0 - 0 1 0 0 0 0 SIXLEQ ent-QOMXAR 5 D 111749 N 105 je je -102 N N NC 1 4 1 835 CAD4-T HELENA refdlf SIXLEQ 1411 1018 1018 87 -0.007(11) D 1 14 0 8 4 16 1 7 2 0 - 0 0 0 0 0 0 TOXYUA 2 Q none N 023 er er +291 N N NC 0 19 1 2931 PW1100 ? unspec TOXYUA 310 283 283 100 0.03(4) Q 0 20 3 40 4 4 62 1 0 0 - 0 1 0 0 0 0 UHIGUN rac-2a D 212184 N 067 rac rac N N N CA 0 14 1 1840 RAXIV raxis ? UHIGUN 400 358 0 - - D 0 17 2 52 7 18 9 7 44 0 - 0 1 0 0 0 0 UHIGUNp+ epr-UHIGUN epr-2a Z 067 je +3190 B N UHIGUNp+ Z 1 0 0 0 0 0 WALGUM 2 J 256360 Y 097 38 je N N N NC 0 19 1 1828 KAPCCD ? refdlf WALGUM 206 247 247 74 -0.01(5) J 0 3 3 15 6 13 10 0 4 0 - 0 0 0 0 0 0 XAXJIP SSSS2a Q none Y 010 er er -2981 N N NC 0 19 1 3696 RAXIIC ? ABSCOR XAXJIP 305 313 313 25 0.45(2) Q 0 4 0 6 3 3 9 1 0 0 100 0 1 0 0 0 1 XAXJIPnt ent-XAXJIP RRRR2a Z 010 er +2990 N N XAXJIPnt Z 1 0 0 0 0 0 XAXJOV RSSR2a Q none Y 010 er er +376 N N NC 1 145 1 2870 SMART ? empirl XAXJOV 296 311 311 34 0.04(1) Q 0 4 0 3 3 3 5 0 2 0 100 0 1 0 0 0 0 XAXJOVnt ent-XAXJOV SRRS2a Z 010 er -370 N N XAXJOVnt Z 1 0 0 0 0 0 XAXJUB RRRR2b Q none Y 010 er er +1727 N N NC 0 19 2 8888 RAXIIC ? ABSCOR XAXJUB 304 316 316 0 0.46(1) Q 0 0 5 9 7 7 11 2 1 0 - 0 1 0 0 0 1 XAXJUBnt ent-XAXJUB SSSS2b Z 010 er er -1743 N N XAXJUBnt Z 1 0 0 0 0 0 XAXKAI RSSS3 Q none Y 010 er er -726 N N NC 1 4 2 3344 SMART ? empirl XAXKAI 305 305 305 100 0.07(2) Q 0 3 2 8 8 8 10 2 1 0 91 0 1 0 0 0 0 XAXKEM ent-XAXKIQ RRRR4a Q none Y 010 er er +389 N N NC 1 4 1 1596 RAXIIC ? ABSCOR XAXKEM 304 296 296 0 0.36(2) Q 0 0 0 3 4 4 3 0 0 0 - 0 1 0 0 0 1 XAXKIQ ent-XAXKEM SSSS4a Q none Y 010 er er -385 N N NC 1 4 1 1596 RAXIIC ? ABSCOR XAXKIQ 304 296 296 0 0.50(2) Q 0 0 0 4 4 4 4 0 0 0 - 0 1 0 0 0 1 XAXKOW RRRR4b Q none Y 010 er er +1799 N N NC 1 4 1 1634 RAXIIC ? ABSCOR XAXKOW 574 677 677 0 0.52(1) Q 0 0 0 5 3 3 4 1 0 0 - 0 1 0 0 0 1 XAXKOWnt ent-XAXKOW SSSS4b Z 010 er -1812 N N XAXKOWnt Z 1 0 0 0 0 0 XAXKUC ent-XAXLAJ RRRR5a Q none Y 010 er er +821 N N NC 1 168 1 5423 RAXIIC ? ABSCOR XAXKUC 303 299 299 45 0.50(2) Q 0 1 0 4 4 4 5 0 0 0 - 0 1 0 0 0 1 XAXLAJ ent-XAXKUC SSSS5a Q none Y 010 er er -811 N N NC 1 168 1 5423 RAXIIC ? ABSCOR XAXLAJ 303 299 299 40 0.47(4) Q 0 1 0 5 4 4 4 1 1 0 - 0 1 0 0 0 1 XAXLEN RRRR6a Q none Y 010 er er +3020 N N NC 1 4 1 1702 RAXIIC ? ABSCOR XAXLEN 307 311 311 41 0.33(2) Q 0 0 0 2 3 3 2 0 0 0 - 0 1 0 0 0 1 XAXLENnt ent-XAXLEN SSSS6a Z 010 er -3032 N N XAXLENnt Z 1 0 0 0 0 0 XAXLIR ent-XAXLOX RRRR7a Q none Y 010 er er +3306 N N NC 1 5 1 3662 RAXIIC ? ABSCOR XAXLIR 296 304 304 20 0.46(3) Q 0 1 0 4 3 3 3 2 0 0 - 0 1 0 0 0 1 XAXLOX ent-XAXLIR SSSS7a Q none Y 010 er er -3337 N N NC 1 5 1 3662 RAXIIC ? ABSCOR XAXLOX 296 304 304 20 0.51(2) Q 0 0 0 4 3 3 3 0 1 0 - 0 1 0 0 0 1 XAXLUD RR8 Q none Y 010 er er +393 N N NC 0 19 1 3720 RAXIIC ? ABSCOR XAXLUD 370 377 377 14 0.44(2) Q 0 - 0 1 0 0 0 1 XIDJUP 6a Q none Y 063 er er -183 N N NC 1 4 1 1732 CAD4 ? ? XIDJUP 278 462 462 0 -0.02(2) Q 0 3 6 18 1 1 26 1 0 0 - 0 1 0 0 0 0 XUNMUO SSp7 D 184930 N 058 er er +40 N N NC 1 4 1 1970 CAD4 xtal37 none XUNMUO 209 264 264 0 ? D 0 27 1 732 5 32 3 8 722 0 - 0 1 0 0 0 0 XUNNAV SRp7 D 184931 N 058 er er +270 N N NC 0 19 1 4071 SMART xtal37 SADABS XUNNAV 222 287 287 45 0 D 0 217 4 900 9 221 11 22 876 0 - 0 1 0 0 0 0 XUXKIK 1 Q none Y 021 rac rac N N N NA 1 29 1 1250 STADI4 ? SADABS XUXKIK 338 453 453 100 0.016(16) Q 0 0 0 0 1 1 0 0 0 0 - 0 1 0 0 1 0 XUXKOQ 17 Q none Y 021 a a N N N NA 1 33 2 2318 CAD4F ? none XUXKOQ 335 453 453 100 0.01(2) Q 0 0 0 1 1 1 0 1 0 0 - 0 1 0 0 0 0 XUXKUW 7 Q none Y 021 a a N N N CA 0 14 1 1596 CAD4F ? none XUXKUW 316 454 0 - - Q 0 0 1 1 1 1 1 1 0 0 - 0 1 0 0 0 0 YIQXEB 6 J 152490 Y 098 rac rac N N N CA 0 14 1 5256 KAPCCD DENZO muscan YIQXEB 1327 1245 0 - - J 1 1 4 12 2 6 5 6 2 0 - 0 0 0 0 0 0 YIQXIF 10 J 178744 Y 098 a a N N N CA 0 60 1 6208 KAPCCD DENZO analyt YIQXIF 1317 1282 0 - - J 0 3 0 6 1 3 2 2 3 0 - 0 0 0 0 0 0 YIQXOL 13 J 178745 Y 098 a a N N N CA 0 15 0.5 5662 KAPCCD DENZO analyt YIQXOL 1190 1210 0 - - J 0 1 3 6 1 3 5 2 1 0 - 0 0 0 0 0 0 033.21Br 21Br N none N 033 ? ? N N N ? ? ? ? ? ? ? ? 033.21Br ? ? ? ? ? N 0 1 0 0 0 0 033.25 25 N none N 033 ? ? N N N ? ? ? ? ? ? ? ? 033.25 ? ? ? ? ? N 0 1 0 0 0 0 063.7b 7b N none Y 063 er er +530 N N ? ? ? ? ? ? ? ? 063.7b 288 374 ? ? ? N 0 1 0 0 0 0 071.337 3.37 N none N 071 er er +977 N N NC 1 004 1 2175 SMART SAINT SADABS 071.337 378 330 330 100 -0.014(13) N 0 1 0 0 0 0 071.359 3.59 N none N 071 ? ? N N N NC 0 019 1 3656 SMART SAINT SADABS 071.359 383 316 316 100 -0.006(15) N 0 1 0 0 0 0 071.369 3.69 N none N 071 ? ? N N N NC 0 019 1 5361 SMART SAINT SADABS 071.369 369 339 339 100 -0.04(3) N 0 1 0 0 0 0 081.10 10 N none Y 081 ? ? N N N NA 1 33 1 3621 ? ? empirl 081.10 1239 1288 1288 100 ? N 0 1 0 0 0 0 081.11 11 N none Y 081 ? ? N N N NC 1 146 1 2884 ? ? empirl 081.11 1202 1331 1331 100 ? N 0 1 0 0 0 0 087.PPN3 PPN3 J none Y 087 rac rac N N N CA 0 2 1 2331 KAPCCD DENZO none 087.PPN3 199 268 0 - - J 0 0 1 10 0 1 8 1 1 0 - 0 1 0 0 0 0 087.5a 5a J none Y 087 er er -881 N N NC 1 4 1 1535 KAPCCD ? muscan 087.5a 223 290 290 57 -0.012(14) J 0 4 1 17 3 13 5 2 5 0 - 0 0 0 0 0 0 087.5b 5b J none Y 087 er er -168 N N NC 0 19 1 3366 KAPCCD ? muscan 087.5b 213 274 274 77 -0.010(18) J 0 4 0 16 3 13 4 1 5 0 - 0 0 0 0 0 0 087.7a 7a J none Y 087 a a N N N CA 0 2 1 1902 SMART SAINT none 087.7a 262 287 0 - - J 0 0 0 13 3 5 2 4 5 0 - 0 1 0 0 0 0 093.3a 3a N none Y 093 er er 73 N N NC 0 19 1 2517 CAD4 ? ? 093.3a 191 314 314 0 0.00(9) N 0 1 0 0 0 0 100.4 4 N none N 100 er er N N N ? ? ? ? ? ? ? ? 100.4 ? ? ? ? ? N 0 1 0 0 0 0 ???????? ?????????? ?????? ?????? ? ? ??? ??? ??? ????? ? ? ?? ? ??? ??? ????? ?????? ?????? ?????? ???????? ???? ???? ???? ????? ????????? ??? ??? ???? ???? ???? ???? ???? ???? ???? ???? ???? ??? ??? ??? ??? ??? ??? ??? COMMENTS TO TABLE CONTENT ------------------------- ADAFUG Abs struc or 0.19 [i 0.64 ]. Chirality is (pR,pR)in CIP convention. Authors give (Sp,Sp). Informed the CCDC. ADAFUG01 Abs struc [i 0.205]. Chirality is (pS,pS)in CIP convention. Authors give (Sp,Sp). ATOTOS BAZQUO01 Chirality is S, pR in CIP convention. Authors give S, Sp in out-moded Schloegl convention. BAZREZ01 Chirality is S, pS in CIP convention. Authors give S, Rp in out-moded Schloegl convention. CEJBAV CEHZUL DAFPAC 93% to P 21/c - Authors don't mention pseudosymmetry - DAC thinks P21 is correct. May be centro. DAFPEG Z = 8 authors, Z = 4 PLATON, Z = 8 CSD. PLATON does not like the half-molecule of solvent. FINYOR GAXWUX GAXZEK GAXZIO GAXZOU GEYQUW01 GEYRUX01 GITSAD GITSEH GOCFUZ In Fig. 2 the molecule is R at C(12) and not S as indicated. GOCGAG GOCGEK GOCGEKnt GOCGIO GOCGOU HAKLOV OR 5meas +271 (D), +278 (577), +215 (546), -58 (435), -87 (405) HAPCOQ Disorder not mentionned by authors. Both molecules have the same chirality but how to apply CIP planar-chirality rules HAPFEJ Both molecules have the same chirality but how to apply CIP planar-chirality rules HORPEJ Z = 8 authors, Z = 2 PLATON, Z = 8 CSD. PLATON does not like the 1/4-molecule of solvent. IDASUC INEVEC Asymmetric unit is pS. It should have been chosen as pR. INEVIG Asymmetric unit is pS. It should have been chosen as pR. Compound name does not have rac- INEVOM Compound has two inequivalent planar chiral bits (pR,pS). Authors names u-8c or (rel)u-8c or (rac)u-8c, etc. It is not meso-. ASK JPD. INEVUS INEWUT INEXAA JANDIM Z: Authors, 1 for 2M+1CH2Cl2; PLATON, 2 for 1M+0.25CCl4; CSD 2 for 1M+0.5CH2Cl2. Disordered solvent not modelled correctly. JANDIMp+ JANDIMp- JANDOS Opposite asymmetric unit to JANDUY JANDUY Z: Authors, 2 for 1M+1S; PLATON, 1 for 2M+2S; CSD 1 for 2M+2S. Opposite asymmetric unit to JANDOS JANFAG JANFEK Z: Authors(paper), 2 for 1M+2S but fig 5 shows dimer 2M; PLATON, 1 for 2M+4S; CSD 1 for 2M+4S. M=C22H25cl2CrHgNo3Ru, S=CH2Cl2. ViewerPro from the authors' CIF show monomers M. JANFIO Origin fixed by no refinement of y Hg. Refinement soft: _computing_structure_refinement LSFM_OpenMoleN_(_1997) JANFIOnt JUXQEY JUXQIC JUXQOI JUXQUO JUXSUQ JUXTOL Z: Authors, 4 for M+0.5S; PLATON, 2 for 2M+S; CSD 4 for M+0.5S. M=C46H43BrN2OFePd, S=MeOH+H2O. KEHXUQ Abs struc is R+/R- LENCOW In the Conquest CIF and Fig. 1, C(12) is S not R as given by authors and CSD. Wrote to CCDC. LENGEQ No coordinates but assigns an absolute configuration LISRAG 1S is 1R, 5S is 5R, 3" Me, is 2"Me, 6"S and alpha R are very far from clear. LISREK Z: Authors, 2 for 2M+1S; PLATON, 2 for 2M+1S; CSD 1 for M+0.5S. M=C35H23NO6PCrMn, S=CH2Cl2. Asymmetric unit is S for a racemate. LISRIO CIF is (1R, 5R, 1"S, alphaR), authors have (1S, 5S, 1"S, alpha R). Reflection count is all wrong. (_diffrn_reflns_number 19396, _reflns_number_total 17050) MIXKEJ MIXKIN MIXKOT MIXKUZ MAXYIU MAXYOA MAXYUG NAHCAB NOGWIP NOGWOV OBOMEY CCDC CIF gave blank report from CheckCif/Platon. After editing, a report was obtained. OBOMIC OBOMOI disordered cyclo-hexyl group could probably be improved. OBOMUO PAXZIY Authors give (R*R*). Asymmetric unit is (S,pS). For 3a,b ccheme 1 p3978 indicates 2 Fe. For 3b one Fe is Ru. Wrong conclusion on p 3978 rh column. PAXZOE Authors give no indication but asymmetric unit is (S) PAXZUK Authors give no indication but asymmetric unit is (S) QAGHIQ/QAGHIQ01 are same data set. Z: Authors, 2 for 2M; PLATON, 2 for 2M; CSD 2 for 2M. M=C24H22CrN2O3Pd. Explained pseudo-centre. diastereo mix dr=1.3:1 (endo:exo). endo-QAGHIQ OR +788 N N. exo-QAGHIQ OR N N N. QAGHOW/QAGHOW01 are same data set. Z: Authors, 2 for 2M; PLATON, 2 for 2M; CSD 4 for 1M. M=C24H22CrN2O3Pd. Explained pseudo-centre diastereo mix dr=1.3:1 (endo:exo). endo-QAGHOW OR -813 N N. exo-QAGHOW OR N N N. QAGHUC/QAGHUC01 are same data set. Disordered solvent. Compound is epr-MIXKOT QAGJAK/QAGJAK01 are same data set. Compound is epr-MIXKOT QOJPAG QOJPEK QOJPIO QOJPOU QOMXAR RALVUW Z: Authors, 1 for 1M; PLATON, 1/2 for 2M; CSD, 1/2 for 2M;. M=C21H26FENO5PD1.50. RIFFAN RIFFER SIXLEQ TOXYUA UHIGUN Asymmetric unit of racemate is pS. UHIGUNp+ WALGUM XAXJIP 100% to P 41 21 2 XAXJIPnt XAXJOV 100% to P 32 2 1 XAXJOVnt XAXJUB Z: Authors give Z = 4. Everyone else has Z = 8 XAXJUBnt XAXKAI 91% to P 21/c XAXKEM XAXKIQ XAXKOW XAXKOWnt XAXKUC XAXLAJ XAXLEN XAXLENnt XAXLIR Z Platon gives Z=2 because of partial solvent molecule XAXLOX XAXLUD No coordinates XIDJUP Disordered side ring. XUNMUO XUNNAV XUXKIK Racemate - asymmetric unit is S. Chemical schema are R. Useful for "Are twin fractions junk parameters" XUXKOQ Useful for "Are twin fractions junk parameters" XUXKUW Racemate - asymmetric unit is pS. YIQXEB disordered CH(OH) 55:45. See extended notes in YIQXEB.txt YIQXIF YIQXOL disordered side chain at C(10) 033.21Br 033.25 063.7b 071.337 071.359 071.369 081.10 081.11 087.PPN3 Asymmetric unit is pS. 087.5a 087.5b 087.7a CIF full of blank lines - needed to edit it to make ViewerPro work. This is a bug of ViewerPro not of CIF. 093.3a 100.4 REFERENCES ---------- * means I have got the reference and entered the stuff into the table above. $ means I looked at the reference but there was no crystal-structure analysis presented in it. First column contains the numeric reference code used in the column "Lit Ref" of the table above. Second column contains the numeric reference code used in the review Djukic, Hijazi, Flack and Bernardinelli unless Jean-Pierre has renumbered the citations yet again! Lit JPD Reference Ref Ref *001 46 G. Zhao, Q.-G. Wang and T.C.W. Mak, Polyhedron, 1998-9, 18, 577-584. *002 45 G. Zhao, Q.-G. Wang and T.C.W. Mak, Organometallics, 1998 17, 3437-3441. *003 52 G. Zhao, Q.-G. Wang and T.C.W. Mak, J. Organometallic Chem., 1999, 574, 311-317. *004 42 G. Zhao, F. Xue, Z.Y. Zhang and T.C.W. Mak, Organometallics, 1997, 16, 4023-4026. *005 43 M. Benito, C. Lopez, X. Solans and M. Font-Bardia Tetrahedron Asym., 1998, 9, 4219-4238. *006 44 G. Zhao, Q.G. Wang and T.C.W. Mak, J. Chem. Soc. Dalton Trans., 1998, 3785-3789. *007 48 G. Zhao, Q.G. Wang and T.C.W. Mak, Tetrahedron Asym., 1998, 9, 2253-2257. *008 50 C. Lopez, A. Caubet, S. Perez, X. Solans and M. Font-Bardia, Chem. Commun., 2004, 540-541. *009 49 Y. Wu, X. Cui, N. Zhou, M. Song, H. Yun, C. Du and Y. Zhu, Tetrahedron Asym., 2000, 11, 4877-4883. *010 47 G. Zhao, Q.C. Yang and T.C.W. Mak, Organometallics, 1999, 18, 3623-3636. $011 10 V.I. Sokolov, J. Organomet. Chem., 1995, 500, 299-306. $012 15 R.S. Paley, Chem. Rev., 2002, 102, 1493-1523. $013 23 L.L. 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