# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2014

 
data_1Y
 
_audit_creation_method            SHELXL-97
_chemical_name_systematic
;
 ?
;
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety      'C12 H8 N4 O16 Y, C24 H20 As'
_chemical_formula_sum
 'C36 H28 As N4 O16 Y'
_chemical_formula_weight          936.45
 
loop_
 _atom_type_symbol
 _atom_type_description
 _atom_type_scat_dispersion_real
 _atom_type_scat_dispersion_imag
 _atom_type_scat_source
 'Y'  'Y'  -2.7962   3.5667
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'C'  'C'   0.0033   0.0016
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'H'  'H'   0.0000   0.0000
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'As'  'As'   0.0499   2.0058
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'N'  'N'   0.0061   0.0033
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'O'  'O'   0.0106   0.0060
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 
_symmetry_cell_setting            'Triclinic'
_symmetry_space_group_name_H-M    'P-1'
 
loop_
 _symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x, -y, -z'
 
_cell_length_a                    10.7426(2)
_cell_length_b                    13.4270(2)
_cell_length_c                    14.1483(3)
_cell_angle_alpha                 71.1379(6)
_cell_angle_beta                  78.6566(6)
_cell_angle_gamma                 85.7839(6)
_cell_volume                      1893.34(6)
_cell_formula_units_Z             2
_cell_measurement_temperature     295
_cell_measurement_reflns_used    22838
_cell_measurement_theta_min       4.31
_cell_measurement_theta_max       30.0
 
_exptl_crystal_description        'block'
_exptl_crystal_colour             'yellow'
_exptl_crystal_size_max           0.38
_exptl_crystal_size_mid           0.29
_exptl_crystal_size_min           0.26
_exptl_crystal_density_meas       ?
_exptl_crystal_density_diffrn     1.643
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000              944
_exptl_absorpt_coefficient_mu     2.488
_exptl_absorpt_correction_type    'empirical'
_exptl_absorpt_correction_T_min   0.447
_exptl_absorpt_correction_T_max   0.512
_exptl_absorpt_process_details    
'SORTAV(R.H. Blessing, Acta Cryst., 1995, A51, 33)'
 
_exptl_special_details
;
 ?
;
 
_diffrn_ambient_temperature       295
_diffrn_radiation_wavelength      0.71073
_diffrn_radiation_type            MoK\a
_diffrn_radiation_source          'fine-focus sealed tube'
_diffrn_radiation_monochromator   graphite
_diffrn_measurement_device_type   'Nonius Kappa CCD'
_diffrn_measurement_method        'φ scans and ω scans'
_diffrn_detector_area_resol_mean  ?
_diffrn_standards_number          ?
_diffrn_standards_interval_count  ?
_diffrn_standards_interval_time   ?
_diffrn_standards_decay_%         ?
_diffrn_reflns_number             22838
_diffrn_reflns_av_R_equivalents   0.0346
_diffrn_reflns_av_unetI/netI     0.0479
_diffrn_reflns_limit_h_min        -14
_diffrn_reflns_limit_h_max        15
_diffrn_reflns_limit_k_min        -18
_diffrn_reflns_limit_k_max        18
_diffrn_reflns_limit_l_min        -16
_diffrn_reflns_limit_l_max        19
_diffrn_reflns_theta_min          4.31
_diffrn_reflns_theta_max          30.03
_reflns_number_total              10914
_reflns_number_gt                 8199
_reflns_threshold_expression      'I>2sigma(I)'
 
_computing_data_collection        'COLLECT (Nonius, 1998)'
_computing_cell_refinement        'Denzo-SMN (Otwinowski & Minor, 1997)'
_computing_data_reduction         'Denzo-SMN (Otwinowski & Minor, 1997)'
_computing_structure_solution     'SIR97 (Altomare et al., 1999)'
_computing_structure_refinement   'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics     'ORTEP III (Burnett & Johnson, 1996)'
_computing_publication_material   
'SHELXL-97 (Sheldrick, 1997), PARST(Nardelli, 1995)'
 
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
 
_refine_ls_structure_factor_coef  Fsqd
_refine_ls_matrix_type            full
_refine_ls_weighting_scheme       calc
_refine_ls_weighting_details
 'calc w=1/[σ²(Fo²)+(0.0461P)²+0.5899P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary      direct
_atom_sites_solution_secondary    difmap
_atom_sites_solution_hydrogens    geom
_refine_ls_hydrogen_treatment     constr
_refine_ls_extinction_method      none
_refine_ls_extinction_coef        ?
_refine_ls_number_reflns          10914
_refine_ls_number_parameters      523
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.0647
_refine_ls_R_factor_gt            0.0410
_refine_ls_wR_factor_ref          0.1037
_refine_ls_wR_factor_gt           0.0957
_refine_ls_goodness_of_fit_ref    1.031
_refine_ls_restrained_S_all       1.031
_refine_ls_shift/su_max           0.000
_refine_ls_shift/su_mean          0.000
 
loop_
 _atom_site_label
 _atom_site_type_symbol
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_U_iso_or_equiv
 _atom_site_adp_type
 _atom_site_occupancy
 _atom_site_symmetry_multiplicity
 _atom_site_calc_flag
 _atom_site_refinement_flags
 _atom_site_disorder_assembly
 _atom_site_disorder_group
Y1 Y 0.244143(19) 0.220743(17) -0.060986(17) 0.04305(7) Uani 1 1 d . . .
O1 O 0.36527(17) 0.06808(14) -0.03110(17) 0.0660(5) Uani 1 1 d . . .
C1 C 0.3492(2) -0.0265(2) -0.0206(2) 0.0596(7) Uani 1 1 d . . .
H1 H 0.4108 -0.0747 0.0046 0.071 Uiso 1 1 calc R . .
C2 C 0.2466(2) -0.06501(18) -0.04368(18) 0.0484(5) Uani 1 1 d . . .
C3 C 0.1481(2) -0.0027(2) -0.0840(2) 0.0526(6) Uani 1 1 d . . .
H3 H 0.0862 -0.0358 -0.1004 0.063 Uiso 1 1 calc R . .
O2 O 0.13680(17) 0.09333(15) -0.09949(16) 0.0624(5) Uani 1 1 d . . .
N1 N 0.2446(2) -0.17554(19) -0.0298(2) 0.0670(6) Uani 1 1 d . . .
O3 O 0.1825(2) -0.20693(17) -0.0767(2) 0.0798(6) Uani 1 1 d . . .
O4 O 0.2992(3) -0.2346(2) 0.0347(3) 0.1302(13) Uani 1 1 d . . .
O5 O 0.3358(2) 0.22454(18) 0.07571(15) 0.0742(6) Uani 1 1 d . . .
C4 C 0.3024(3) 0.2066(2) 0.1682(2) 0.0610(7) Uani 1 1 d . . .
H4 H 0.3577 0.2249 0.2028 0.073 Uiso 1 1 calc R . .
C5 C 0.1871(2) 0.16054(17) 0.22452(18) 0.0464(5) Uani 1 1 d . . .
C6 C 0.0947(2) 0.13260(18) 0.18092(19) 0.0493(5) Uani 1 1 d . . .
H6 H 0.0197 0.1042 0.2238 0.059 Uiso 1 1 calc R . .
O6 O 0.10512(15) 0.14291(14) 0.08903(13) 0.0523(4) Uani 1 1 d . . .
N2 N 0.1611(3) 0.14312(17) 0.33130(17) 0.0611(6) Uani 1 1 d . . .
O7 O 0.2387(3) 0.1719(2) 0.36981(18) 0.0983(8) Uani 1 1 d . . .
O8 O 0.0623(2) 0.10003(18) 0.38235(16) 0.0791(6) Uani 1 1 d . . .
O9 O 0.44978(15) 0.28294(14) -0.12756(14) 0.0557(4) Uani 1 1 d . . .
C7 C 0.5046(2) 0.3654(2) -0.13570(19) 0.0556(6) Uani 1 1 d . . .
H7 H 0.5922 0.3675 -0.1571 0.067 Uiso 1 1 calc R . .
C8 C 0.4454(2) 0.4539(2) -0.11548(18) 0.0531(6) Uani 1 1 d . . .
C9 C 0.3166(3) 0.4637(2) -0.0795(2) 0.0588(6) Uani 1 1 d . . .
H9 H 0.2882 0.5263 -0.0673 0.071 Uiso 1 1 calc R . .
O10 O 0.23631(17) 0.39429(15) -0.06250(17) 0.0657(5) Uani 1 1 d . . .
N3 N 0.5210(3) 0.5458(2) -0.13705(19) 0.0710(7) Uani 1 1 d . . .
O11 O 0.6368(2) 0.5353(2) -0.1524(2) 0.1019(8) Uani 1 1 d . . .
O12 O 0.4671(3) 0.6309(2) -0.1415(2) 0.1037(9) Uani 1 1 d . . .
O13 O 0.04901(16) 0.29382(14) -0.10036(14) 0.0569(4) Uani 1 1 d . . .
C10 C 0.0009(2) 0.32190(19) -0.1779(2) 0.0549(6) Uani 1 1 d . . .
H10 H -0.0848 0.3403 -0.1708 0.066 Uiso 1 1 calc R . .
C11 C 0.0671(3) 0.32772(19) -0.2757(2) 0.0541(6) Uani 1 1 d . . .
C12 C 0.1957(3) 0.3050(2) -0.2998(2) 0.0577(6) Uani 1 1 d . . .
H12 H 0.2292 0.3137 -0.3677 0.069 Uiso 1 1 calc R . .
O14 O 0.26982(17) 0.27423(15) -0.23835(14) 0.0590(4) Uani 1 1 d . . .
N4 N -0.0016(3) 0.3619(2) -0.3589(2) 0.0712(7) Uani 1 1 d . . .
O15 O 0.0543(3) 0.3658(3) -0.4440(2) 0.1120(10) Uani 1 1 d . . .
O16 O -0.1141(2) 0.38351(19) -0.3408(2) 0.0881(7) Uani 1 1 d . . .
As1 As -0.27798(2) -0.755856(17) -0.585032(17) 0.04298(7) Uani 1 1 d . . .
C13 C -0.2453(2) -0.80008(17) -0.44918(18) 0.0465(5) Uani 1 1 d . . .
C14 C -0.1277(2) -0.84111(19) -0.42868(19) 0.0516(6) Uani 1 1 d . . .
H14 H -0.0630 -0.8464 -0.4812 0.062 Uiso 1 1 calc R . .
C15 C -0.1073(3) -0.8742(2) -0.3297(2) 0.0604(7) Uani 1 1 d . . .
H15 H -0.0286 -0.9019 -0.3157 0.072 Uiso 1 1 calc R . .
C16 C -0.2025(3) -0.8663(2) -0.2520(2) 0.0685(8) Uani 1 1 d . . .
H16 H -0.1878 -0.8879 -0.1857 0.082 Uiso 1 1 calc R . .
C17 C -0.3205(3) -0.8263(2) -0.2721(2) 0.0714(8) Uani 1 1 d . . .
H17 H -0.3852 -0.8221 -0.2191 0.086 Uiso 1 1 calc R . .
C18 C -0.3423(3) -0.7926(2) -0.3709(2) 0.0581(6) Uani 1 1 d . . .
H18 H -0.4213 -0.7652 -0.3847 0.070 Uiso 1 1 calc R . .
C19 C -0.3151(2) -0.87592(18) -0.61983(18) 0.0479(5) Uani 1 1 d . . .
C20 C -0.3959(3) -0.8661(2) -0.6876(2) 0.0628(7) Uani 1 1 d . . .
H20 H -0.4353 -0.8020 -0.7149 0.075 Uiso 1 1 calc R . .
C21 C -0.4172(3) -0.9531(2) -0.7141(3) 0.0720(8) Uani 1 1 d . . .
H21 H -0.4719 -0.9477 -0.7590 0.086 Uiso 1 1 calc R . .
C22 C -0.3577(3) -1.0479(2) -0.6741(3) 0.0701(8) Uani 1 1 d . . .
H22 H -0.3722 -1.1060 -0.6924 0.084 Uiso 1 1 calc R . .
C23 C -0.2773(3) -1.0567(2) -0.6076(3) 0.0699(8) Uani 1 1 d . . .
H23 H -0.2372 -1.1207 -0.5814 0.084 Uiso 1 1 calc R . .
C24 C -0.2552(3) -0.97047(19) -0.5790(2) 0.0584(6) Uani 1 1 d . . .
H24 H -0.2012 -0.9764 -0.5335 0.070 Uiso 1 1 calc R . .
C25 C -0.4192(2) -0.66030(19) -0.59361(18) 0.0483(5) Uani 1 1 d . . .
C26 C -0.3948(3) -0.55339(19) -0.62200(19) 0.0534(6) Uani 1 1 d . . .
H26 H -0.3117 -0.5297 -0.6380 0.064 Uiso 1 1 calc R . .
C27 C -0.4953(3) -0.4829(2) -0.6262(2) 0.0665(8) Uani 1 1 d . . .
H27 H -0.4800 -0.4113 -0.6441 0.080 Uiso 1 1 calc R . .
C28 C -0.6171(3) -0.5178(3) -0.6042(2) 0.0748(9) Uani 1 1 d . . .
H28 H -0.6842 -0.4696 -0.6071 0.090 Uiso 1 1 calc R . .
C29 C -0.6418(3) -0.6235(3) -0.5776(2) 0.0736(8) Uani 1 1 d . . .
H29 H -0.7252 -0.6461 -0.5639 0.088 Uiso 1 1 calc R . .
C30 C -0.5428(3) -0.6962(2) -0.5713(2) 0.0627(7) Uani 1 1 d . . .
H30 H -0.5589 -0.7678 -0.5524 0.075 Uiso 1 1 calc R . .
C31 C -0.1367(2) -0.68408(16) -0.68104(17) 0.0420(5) Uani 1 1 d . . .
C32 C -0.1318(2) -0.67519(19) -0.78193(19) 0.0498(5) Uani 1 1 d . . .
H32 H -0.1952 -0.7045 -0.8006 0.060 Uiso 1 1 calc R . .
C33 C -0.0325(3) -0.6225(2) -0.8548(2) 0.0560(6) Uani 1 1 d . . .
H33 H -0.0292 -0.6159 -0.9228 0.067 Uiso 1 1 calc R . .
C34 C 0.0613(3) -0.5800(2) -0.8271(2) 0.0576(6) Uani 1 1 d . . .
H34 H 0.1284 -0.5452 -0.8763 0.069 Uiso 1 1 calc R . .
C35 C 0.0564(3) -0.5888(2) -0.7268(2) 0.0590(6) Uani 1 1 d . . .
H35 H 0.1210 -0.5601 -0.7088 0.071 Uiso 1 1 calc R . .
C36 C -0.0431(2) -0.63969(19) -0.6521(2) 0.0518(5) Uani 1 1 d . . .
H36 H -0.0473 -0.6441 -0.5846 0.062 Uiso 1 1 calc R . .
 
 
_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
 
loop_
 _geom_bond_atom_site_label_1
 _geom_bond_atom_site_label_2
 _geom_bond_distance
 _geom_bond_site_symmetry_2
 _geom_bond_publ_flag
Y1 O1 2.3104(18) . ?
Y1 O6 2.3186(17) . ?
Y1 O10 2.3189(18) . ?
Y1 O9 2.3257(16) . ?
Y1 O13 2.3389(17) . ?
Y1 O14 2.3410(18) . ?
Y1 O5 2.3524(19) . ?
Y1 O2 2.3860(18) . ?
O1 C1 1.251(3) . ?
C1 C2 1.386(3) . ?
C1 H1 0.9300 . ?
C2 C3 1.395(4) . ?
C2 N1 1.434(3) . ?
C3 O2 1.237(3) . ?
C3 H3 0.9300 . ?
N1 O3 1.208(3) . ?
N1 O4 1.216(4) . ?
O5 C4 1.234(3) . ?
C4 C5 1.399(4) . ?
C4 H4 0.9300 . ?
C5 C6 1.397(3) . ?
C5 N2 1.425(3) . ?
C6 O6 1.245(3) . ?
C6 H6 0.9300 . ?
N2 O7 1.226(3) . ?
N2 O8 1.225(3) . ?
O9 C7 1.254(3) . ?
C7 C8 1.392(4) . ?
C7 H7 0.9300 . ?
C8 C9 1.389(4) . ?
C8 N3 1.442(3) . ?
C9 O10 1.250(3) . ?
C9 H9 0.9300 . ?
N3 O11 1.226(4) . ?
N3 O12 1.230(4) . ?
O13 C10 1.241(3) . ?
C10 C11 1.406(4) . ?
C10 H10 0.9300 . ?
C11 C12 1.391(4) . ?
C11 N4 1.443(4) . ?
C12 O14 1.246(3) . ?
C12 H12 0.9300 . ?
N4 O16 1.219(3) . ?
N4 O15 1.223(4) . ?
As1 C31 1.907(2) . ?
As1 C25 1.910(2) . ?
As1 C13 1.915(2) . ?
As1 C19 1.920(2) . ?
C13 C14 1.386(4) . ?
C13 C18 1.387(3) . ?
C14 C15 1.382(4) . ?
C14 H14 0.9300 . ?
C15 C16 1.373(4) . ?
C15 H15 0.9300 . ?
C16 C17 1.385(5) . ?
C16 H16 0.9300 . ?
C17 C18 1.386(4) . ?
C17 H17 0.9300 . ?
C18 H18 0.9300 . ?
C19 C24 1.383(4) . ?
C19 C20 1.385(4) . ?
C20 C21 1.383(4) . ?
C20 H20 0.9300 . ?
C21 C22 1.380(5) . ?
C21 H21 0.9300 . ?
C22 C23 1.370(5) . ?
C22 H22 0.9300 . ?
C23 C24 1.393(4) . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
C25 C30 1.388(4) . ?
C25 C26 1.390(4) . ?
C26 C27 1.380(4) . ?
C26 H26 0.9300 . ?
C27 C28 1.365(5) . ?
C27 H27 0.9300 . ?
C28 C29 1.377(5) . ?
C28 H28 0.9300 . ?
C29 C30 1.387(4) . ?
C29 H29 0.9300 . ?
C30 H30 0.9300 . ?
C31 C32 1.384(3) . ?
C31 C36 1.393(3) . ?
C32 C33 1.382(4) . ?
C32 H32 0.9300 . ?
C33 C34 1.370(4) . ?
C33 H33 0.9300 . ?
C34 C35 1.377(4) . ?
C34 H34 0.9300 . ?
C35 C36 1.386(4) . ?
C35 H35 0.9300 . ?
C36 H36 0.9300 . ?
 
loop_
 _geom_angle_atom_site_label_1
 _geom_angle_atom_site_label_2
 _geom_angle_atom_site_label_3
 _geom_angle
 _geom_angle_site_symmetry_1
 _geom_angle_site_symmetry_3
 _geom_angle_publ_flag
O1 Y1 O6 89.03(7) . . ?
O1 Y1 O10 144.09(6) . . ?
O6 Y1 O10 101.01(7) . . ?
O1 Y1 O9 77.18(6) . . ?
O6 Y1 O9 143.64(6) . . ?
O10 Y1 O9 74.46(6) . . ?
O1 Y1 O13 144.12(6) . . ?
O6 Y1 O13 78.01(6) . . ?
O10 Y1 O13 71.72(7) . . ?
O9 Y1 O13 130.86(6) . . ?
O1 Y1 O14 100.71(7) . . ?
O6 Y1 O14 144.08(6) . . ?
O10 Y1 O14 91.14(7) . . ?
O9 Y1 O14 72.15(6) . . ?
O13 Y1 O14 73.96(6) . . ?
O1 Y1 O5 77.75(8) . . ?
O6 Y1 O5 71.57(6) . . ?
O10 Y1 O5 73.13(8) . . ?
O9 Y1 O5 72.67(7) . . ?
O13 Y1 O5 127.24(8) . . ?
O14 Y1 O5 144.18(6) . . ?
O1 Y1 O2 72.28(6) . . ?
O6 Y1 O2 76.21(7) . . ?
O10 Y1 O2 143.53(7) . . ?
O9 Y1 O2 128.59(7) . . ?
O13 Y1 O2 72.17(6) . . ?
O14 Y1 O2 74.15(7) . . ?
O5 Y1 O2 135.85(7) . . ?
C1 O1 Y1 136.53(16) . . ?
O1 C1 C2 125.0(2) . . ?
O1 C1 H1 117.5 . . ?
C2 C1 H1 117.5 . . ?
C1 C2 C3 124.4(2) . . ?
C1 C2 N1 117.9(2) . . ?
C3 C2 N1 117.7(2) . . ?
O2 C3 C2 124.9(2) . . ?
O2 C3 H3 117.6 . . ?
C2 C3 H3 117.6 . . ?
C3 O2 Y1 134.91(16) . . ?
O3 N1 O4 122.6(3) . . ?
O3 N1 C2 119.4(2) . . ?
O4 N1 C2 117.7(2) . . ?
C4 O5 Y1 137.32(18) . . ?
O5 C4 C5 124.4(2) . . ?
O5 C4 H4 117.8 . . ?
C5 C4 H4 117.8 . . ?
C6 C5 C4 123.2(2) . . ?
C6 C5 N2 118.2(2) . . ?
C4 C5 N2 118.6(2) . . ?
O6 C6 C5 124.9(2) . . ?
O6 C6 H6 117.5 . . ?
C5 C6 H6 117.5 . . ?
C6 O6 Y1 137.61(15) . . ?
O7 N2 O8 121.6(3) . . ?
O7 N2 C5 118.8(3) . . ?
O8 N2 C5 119.5(2) . . ?
C7 O9 Y1 133.91(17) . . ?
O9 C7 C8 125.5(2) . . ?
O9 C7 H7 117.2 . . ?
C8 C7 H7 117.2 . . ?
C9 C8 C7 125.4(2) . . ?
C9 C8 N3 116.0(3) . . ?
C7 C8 N3 118.5(2) . . ?
O10 C9 C8 124.6(3) . . ?
O10 C9 H9 117.7 . . ?
C8 C9 H9 117.7 . . ?
C9 O10 Y1 135.26(18) . . ?
O11 N3 O12 123.2(3) . . ?
O11 N3 C8 117.8(3) . . ?
O12 N3 C8 119.0(3) . . ?
C10 O13 Y1 135.29(17) . . ?
O13 C10 C11 124.4(2) . . ?
O13 C10 H10 117.8 . . ?
C11 C10 H10 117.8 . . ?
C12 C11 C10 125.2(2) . . ?
C12 C11 N4 116.6(3) . . ?
C10 C11 N4 118.2(3) . . ?
O14 C12 C11 125.7(3) . . ?
O14 C12 H12 117.1 . . ?
C11 C12 H12 117.1 . . ?
C12 O14 Y1 134.19(18) . . ?
O16 N4 O15 122.5(3) . . ?
O16 N4 C11 118.5(3) . . ?
O15 N4 C11 119.0(3) . . ?
C31 As1 C25 107.55(10) . . ?
C31 As1 C13 111.72(10) . . ?
C25 As1 C13 108.98(10) . . ?
C31 As1 C19 108.88(10) . . ?
C25 As1 C19 109.87(11) . . ?
C13 As1 C19 109.80(10) . . ?
C14 C13 C18 120.3(2) . . ?
C14 C13 As1 120.78(17) . . ?
C18 C13 As1 118.9(2) . . ?
C15 C14 C13 119.6(2) . . ?
C15 C14 H14 120.2 . . ?
C13 C14 H14 120.2 . . ?
C16 C15 C14 120.4(3) . . ?
C16 C15 H15 119.8 . . ?
C14 C15 H15 119.8 . . ?
C15 C16 C17 120.1(3) . . ?
C15 C16 H16 119.9 . . ?
C17 C16 H16 119.9 . . ?
C18 C17 C16 120.2(3) . . ?
C18 C17 H17 119.9 . . ?
C16 C17 H17 119.9 . . ?
C17 C18 C13 119.3(3) . . ?
C17 C18 H18 120.3 . . ?
C13 C18 H18 120.3 . . ?
C24 C19 C20 121.3(2) . . ?
C24 C19 As1 118.3(2) . . ?
C20 C19 As1 120.35(19) . . ?
C21 C20 C19 119.1(3) . . ?
C21 C20 H20 120.5 . . ?
C19 C20 H20 120.5 . . ?
C22 C21 C20 120.3(3) . . ?
C22 C21 H21 119.9 . . ?
C20 C21 H21 119.9 . . ?
C23 C22 C21 120.3(3) . . ?
C23 C22 H22 119.9 . . ?
C21 C22 H22 119.9 . . ?
C22 C23 C24 120.6(3) . . ?
C22 C23 H23 119.7 . . ?
C24 C23 H23 119.7 . . ?
C19 C24 C23 118.6(3) . . ?
C19 C24 H24 120.7 . . ?
C23 C24 H24 120.7 . . ?
C30 C25 C26 120.8(2) . . ?
C30 C25 As1 121.2(2) . . ?
C26 C25 As1 118.05(19) . . ?
C27 C26 C25 119.2(3) . . ?
C27 C26 H26 120.4 . . ?
C25 C26 H26 120.4 . . ?
C28 C27 C26 120.3(3) . . ?
C28 C27 H27 119.8 . . ?
C26 C27 H27 119.8 . . ?
C27 C28 C29 120.8(3) . . ?
C27 C28 H28 119.6 . . ?
C29 C28 H28 119.6 . . ?
C28 C29 C30 120.2(3) . . ?
C28 C29 H29 119.9 . . ?
C30 C29 H29 119.9 . . ?
C29 C30 C25 118.8(3) . . ?
C29 C30 H30 120.6 . . ?
C25 C30 H30 120.6 . . ?
C32 C31 C36 120.8(2) . . ?
C32 C31 As1 117.34(17) . . ?
C36 C31 As1 121.85(18) . . ?
C33 C32 C31 119.7(2) . . ?
C33 C32 H32 120.1 . . ?
C31 C32 H32 120.1 . . ?
C34 C33 C32 120.1(3) . . ?
C34 C33 H33 120.0 . . ?
C32 C33 H33 120.0 . . ?
C33 C34 C35 120.2(2) . . ?
C33 C34 H34 119.9 . . ?
C35 C34 H34 119.9 . . ?
C34 C35 C36 121.0(2) . . ?
C34 C35 H35 119.5 . . ?
C36 C35 H35 119.5 . . ?
C35 C36 C31 118.1(2) . . ?
C35 C36 H36 120.9 . . ?
C31 C36 H36 120.9 . . ?
 
_diffrn_measured_fraction_theta_max    0.986
_diffrn_reflns_theta_full              30.03
_diffrn_measured_fraction_theta_full   0.986
_refine_diff_density_max    0.709
_refine_diff_density_min   -0.619
_refine_diff_density_rms    0.061
