# Copyright The Royal Society of Chemistry, 1999 # CCDC Number: 182/1206 data_cc109 _audit_creation_method SHELXL _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_formula_moiety ? _chemical_formula_structural ? _chemical_formula_analytical ? _chemical_formula_sum 'C Ag3 N3 O6 S' _chemical_formula_weight 505.71 _chemical_melting_point ? _chemical_compound_source ? loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'C' 'C' 0.0033 0.0016 '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' 'S' 'S' 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Ag' 'Ag' -0.8971 1.1015 '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 (No. 2)' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' _cell_length_a 6.569(5) _cell_length_b 7.7320(10) _cell_length_c 8.031(2) _cell_angle_alpha 104.09(1) _cell_angle_beta 93.94(4) _cell_angle_gamma 90.04(3) _cell_volume 394.6(3) _cell_formula_units_Z 2 _cell_measurement_temperature 293(2) _cell_measurement_reflns_used 25 _cell_measurement_theta_min 6 _cell_measurement_theta_max 15 _exptl_crystal_description Prism _exptl_crystal_colour Colorless _exptl_crystal_size_max 0.45 _exptl_crystal_size_mid 0.20 _exptl_crystal_size_min 0.20 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 4.256 _exptl_crystal_density_method ? _exptl_crystal_F_000 464 _exptl_absorpt_coefficient_mu 7.641 _exptl_absorpt_correction_type Psi _exptl_absorpt_correction_T_min 0.680 _exptl_absorpt_correction_T_max 0.992 _exptl_special_details ; ? ; _diffrn_ambient_temperature 293(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_monochromator graphite _diffrn_measurement_device 'Siemens P4/PC' _diffrn_measurement_method w _diffrn_standards_number 3 _diffrn_standards_interval_count 200 _diffrn_standards_interval_time ? _diffrn_standards_decay_% ? _diffrn_reflns_number 2829 _diffrn_reflns_av_R_equivalents 0.0247 _diffrn_reflns_av_sigmaI/netI 0.0726 _diffrn_reflns_limit_h_min -1 _diffrn_reflns_limit_h_max 9 _diffrn_reflns_limit_k_min -10 _diffrn_reflns_limit_k_max 10 _diffrn_reflns_limit_l_min -11 _diffrn_reflns_limit_l_max 11 _diffrn_reflns_theta_min 2.62 _diffrn_reflns_theta_max 30.00 _reflns_number_total 2275 _reflns_number_observed 1423 _reflns_observed_criterion >2sigma(I) _computing_data_collection ? _computing_cell_refinement ? _computing_data_reduction ? _computing_structure_solution 'SHELXS-86 (Sheldrick, 1990)' _computing_structure_refinement 'SHELXL-93 (Sheldrick, 1993)' _computing_molecular_graphics ? _computing_publication_material ? _refine_special_details ; Refinement on F^2^ for ALL reflections except for 7 with very negative F^2^ or flagged by the user for potential systematic errors. Weighted R-factors wR and all goodnesses of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The observed criterion of F^2^ > 2sigma(F^2^) is used only for calculating _R_factor_obs etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ 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 w=1/[\s^2^(Fo^2^)+(0.0282P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment ? _refine_ls_extinction_method SHELXL _refine_ls_extinction_coef 0.0256(4) _refine_ls_extinction_expression 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^' _refine_ls_number_reflns 2268 _refine_ls_number_parameters 131 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0734 _refine_ls_R_factor_obs 0.0394 _refine_ls_wR_factor_all 0.0791 _refine_ls_wR_factor_obs 0.0690 _refine_ls_goodness_of_fit_all 0.846 _refine_ls_goodness_of_fit_obs 0.990 _refine_ls_restrained_S_all 0.887 _refine_ls_restrained_S_obs 0.990 _refine_ls_shift/esd_max 0.002 _refine_ls_shift/esd_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_thermal_displace_type _atom_site_occupancy _atom_site_calc_flag _atom_site_refinement_flags _atom_site_disorder_group Ag1 Ag 0.45832(6) 0.26962(5) 0.13590(4) 0.03927(10) Uani 1 d . . Ag2 Ag 1.0000 0.0000 0.5000 0.0472(2) Uani 1 d S . Ag3 Ag 0.5000 0.0000 0.5000 0.0494(2) Uani 1 d S . Ag4 Ag 1.02368(7) 0.64368(5) 0.82310(6) 0.06058(14) Uani 1 d . . S1 S 0.7289(2) 0.21464(13) 0.39367(13) 0.0319(3) Uani 1 d . . C1 C 0.7305(7) 0.3885(5) 0.5638(5) 0.0275(10) Uani 1 d . . N1 N 0.7334(6) 0.5083(5) 0.6811(4) 0.0370(10) Uani 1 d . . N2 N 0.3174(6) 0.3220(4) -0.2138(4) 0.0338(10) Uani 1 d . . O1 O 0.2445(6) 0.3159(4) -0.3618(3) 0.0482(10) Uani 1 d . . O2 O 0.4269(5) 0.2013(4) -0.1829(4) 0.0451(9) Uani 1 d . . O3 O 0.2774(5) 0.4518(4) -0.0902(4) 0.0418(9) Uani 1 d . . N3 N 0.8301(6) 0.0624(4) 0.8667(4) 0.0309(9) Uani 1 d . . O4 O 0.7646(6) 0.0535(5) 1.0057(4) 0.0618(11) Uani 1 d . . O5 O 0.9310(6) 0.1923(4) 0.8540(5) 0.0607(12) Uani 1 d . . O6 O 0.7912(6) -0.0635(4) 0.7378(4) 0.0447(9) Uani 1 d . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Ag1 0.0445(2) 0.0349(2) 0.0353(2) 0.00253(13) 0.0031(2) 0.0033(2) Ag2 0.0560(4) 0.0539(3) 0.0358(2) 0.0168(2) 0.0101(2) 0.0199(3) Ag3 0.0549(4) 0.0444(3) 0.0473(3) 0.0111(2) -0.0060(3) -0.0159(3) Ag4 0.0540(3) 0.0394(2) 0.0733(3) -0.0090(2) -0.0184(2) 0.0040(2) S1 0.0400(6) 0.0269(5) 0.0250(4) 0.0000(4) -0.0002(5) 0.0025(5) C1 0.031(2) 0.026(2) 0.027(2) 0.0098(15) 0.000(2) 0.001(2) N1 0.048(2) 0.030(2) 0.029(2) -0.0003(14) 0.000(2) -0.001(2) N2 0.037(2) 0.030(2) 0.034(2) 0.0053(15) 0.005(2) -0.008(2) O1 0.064(2) 0.051(2) 0.0298(15) 0.0126(13) -0.006(2) -0.006(2) O2 0.050(2) 0.033(2) 0.055(2) 0.0148(14) 0.002(2) 0.012(2) O3 0.055(2) 0.0285(15) 0.0343(15) -0.0063(12) 0.003(2) 0.002(2) N3 0.034(2) 0.028(2) 0.028(2) 0.0033(13) -0.003(2) 0.008(2) O4 0.070(2) 0.092(3) 0.031(2) 0.024(2) 0.017(2) 0.034(2) O5 0.051(2) 0.034(2) 0.101(3) 0.028(2) -0.010(2) -0.012(2) O6 0.056(2) 0.0317(15) 0.037(2) -0.0078(13) -0.007(2) 0.005(2) _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 Ag1 N1 2.392(4) 2_666 ? Ag1 O2 2.479(3) . ? Ag1 S1 2.7477(15) . ? Ag1 Ag4 3.259(2) 2_666 ? Ag2 O6 2.566(4) 2_756 ? Ag2 O6 2.566(4) . ? Ag2 S1 2.6720(14) . ? Ag2 S1 2.6720(14) 2_756 ? Ag2 Ag3 3.285(2) . ? Ag2 Ag3 3.285(2) 1_655 ? Ag3 S1 2.5706(14) . ? Ag3 S1 2.5706(14) 2_656 ? Ag3 Ag2 3.284(2) 1_455 ? Ag4 N1 2.269(4) . ? Ag4 O3 2.411(3) 1_656 ? Ag4 O5 2.591(4) 2_767 ? Ag4 S1 2.861(2) 2_766 ? Ag4 Ag1 3.259(2) 2_666 ? S1 C1 1.667(4) . ? S1 Ag4 2.861(2) 2_766 ? C1 N1 1.148(5) . ? N1 Ag1 2.392(4) 2_666 ? N2 O2 1.241(5) . ? N2 O1 1.240(4) . ? N2 O3 1.270(4) . ? O3 Ag4 2.411(3) 1_454 ? N3 O5 1.232(5) . ? N3 O4 1.241(5) . ? N3 O6 1.248(4) . ? O5 Ag4 2.591(4) 2_767 ? 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 N1 Ag1 O2 124.41(11) 2_666 . ? N1 Ag1 S1 95.61(9) 2_666 . ? O2 Ag1 S1 138.46(8) . . ? N1 Ag1 Ag4 44.12(9) 2_666 2_666 ? O2 Ag1 Ag4 94.52(8) . 2_666 ? S1 Ag1 Ag4 124.93(4) . 2_666 ? O6 Ag2 O6 180.0 2_756 . ? O6 Ag2 S1 83.95(9) 2_756 . ? O6 Ag2 S1 96.05(9) . . ? O6 Ag2 S1 96.05(9) 2_756 2_756 ? O6 Ag2 S1 83.95(9) . 2_756 ? S1 Ag2 S1 180.0 . 2_756 ? O6 Ag2 Ag3 125.84(8) 2_756 . ? O6 Ag2 Ag3 54.16(8) . . ? S1 Ag2 Ag3 49.84(3) . . ? S1 Ag2 Ag3 130.16(3) 2_756 . ? O6 Ag2 Ag3 54.16(8) 2_756 1_655 ? O6 Ag2 Ag3 125.84(8) . 1_655 ? S1 Ag2 Ag3 130.16(3) . 1_655 ? S1 Ag2 Ag3 49.84(3) 2_756 1_655 ? Ag3 Ag2 Ag3 180.0 . 1_655 ? S1 Ag3 S1 180.0 . 2_656 ? S1 Ag3 Ag2 127.40(3) . 1_455 ? S1 Ag3 Ag2 52.60(3) 2_656 1_455 ? S1 Ag3 Ag2 52.60(3) . . ? S1 Ag3 Ag2 127.40(3) 2_656 . ? Ag2 Ag3 Ag2 180.0 1_455 . ? N1 Ag4 O3 116.40(12) . 1_656 ? N1 Ag4 O5 126.22(13) . 2_767 ? O3 Ag4 O5 82.37(10) 1_656 2_767 ? N1 Ag4 S1 112.63(10) . 2_766 ? O3 Ag4 S1 96.83(9) 1_656 2_766 ? O5 Ag4 S1 114.30(9) 2_767 2_766 ? N1 Ag4 Ag1 47.21(9) . 2_666 ? O3 Ag4 Ag1 138.98(9) 1_656 2_666 ? O5 Ag4 Ag1 84.59(9) 2_767 2_666 ? S1 Ag4 Ag1 123.91(4) 2_766 2_666 ? C1 S1 Ag3 98.9(2) . . ? C1 S1 Ag2 102.22(15) . . ? Ag3 S1 Ag2 77.56(5) . . ? C1 S1 Ag1 110.04(15) . . ? Ag3 S1 Ag1 96.80(5) . . ? Ag2 S1 Ag1 147.74(4) . . ? C1 S1 Ag4 100.1(2) . 2_766 ? Ag3 S1 Ag4 160.94(4) . 2_766 ? Ag2 S1 Ag4 99.21(6) . 2_766 ? Ag1 S1 Ag4 75.77(5) . 2_766 ? N1 C1 S1 179.4(4) . . ? C1 N1 Ag4 124.0(4) . . ? C1 N1 Ag1 147.1(4) . 2_666 ? Ag4 N1 Ag1 88.68(11) . 2_666 ? O2 N2 O1 121.2(3) . . ? O2 N2 O3 118.8(3) . . ? O1 N2 O3 120.0(4) . . ? N2 O2 Ag1 103.3(2) . . ? N2 O3 Ag4 112.1(2) . 1_454 ? O5 N3 O4 121.4(4) . . ? O5 N3 O6 119.9(4) . . ? O4 N3 O6 118.7(4) . . ? N3 O5 Ag4 98.8(3) . 2_767 ? N3 O6 Ag2 106.1(3) . . ? _refine_diff_density_max 2.241 _refine_diff_density_min -1.827 _refine_diff_density_rms 0.179 data_cc112 _audit_creation_method SHELXL _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_formula_moiety ? _chemical_formula_structural ? _chemical_formula_analytical ? _chemical_formula_sum 'C Ag2 Cl N O4 S' _chemical_formula_weight 373.27 _chemical_melting_point ? _chemical_compound_source ? loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'C' 'C' 0.0033 0.0016 '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' 'S' 'S' 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Cl' 'Cl' 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Ag' 'Ag' -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _symmetry_cell_setting Monoclinic _symmetry_space_group_name_H-M 'C2/c (No. 15)' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, y, -z+1/2' 'x+1/2, y+1/2, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y, z-1/2' '-x+1/2, -y+1/2, -z' 'x+1/2, -y+1/2, z-1/2' _cell_length_a 15.294(4) _cell_length_b 4.7655(10) _cell_length_c 18.278(4) _cell_angle_alpha 90.00 _cell_angle_beta 109.89(2) _cell_angle_gamma 90.00 _cell_volume 1252.7(5) _cell_formula_units_Z 8 _cell_measurement_temperature 293(2) _cell_measurement_reflns_used ? _cell_measurement_theta_min ? _cell_measurement_theta_max ? _exptl_crystal_description Needle _exptl_crystal_colour 'pale purple' _exptl_crystal_size_max 0.38 _exptl_crystal_size_mid 0.11 _exptl_crystal_size_min 0.06 _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 3.958 _exptl_crystal_density_method ? _exptl_crystal_F_000 1376 _exptl_absorpt_coefficient_mu 6.955 _exptl_absorpt_correction_type ABSCOR _exptl_absorpt_correction_T_min 0.787 _exptl_absorpt_correction_T_max 1.0 _exptl_special_details ; ? ; _diffrn_ambient_temperature 293(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_monochromator graphite _diffrn_measurement_device ? _diffrn_measurement_method ? _diffrn_standards_number ? _diffrn_standards_interval_count ? _diffrn_standards_interval_time ? _diffrn_standards_decay_% ? _diffrn_reflns_number 1867 _diffrn_reflns_av_R_equivalents 0.0862 _diffrn_reflns_av_sigmaI/netI 0.0867 _diffrn_reflns_limit_h_min -4 _diffrn_reflns_limit_h_max 18 _diffrn_reflns_limit_k_min -5 _diffrn_reflns_limit_k_max 5 _diffrn_reflns_limit_l_min -22 _diffrn_reflns_limit_l_max 19 _diffrn_reflns_theta_min 2.37 _diffrn_reflns_theta_max 25.66 _reflns_number_total 1086 _reflns_number_observed 1032 _reflns_observed_criterion >2sigma(I) _computing_data_collection ? _computing_cell_refinement ? _computing_data_reduction ? _computing_structure_solution 'SHELXS-86 (Sheldrick, 1990)' _computing_structure_refinement 'SHELXL-93 (Sheldrick, 1993)' _computing_molecular_graphics ? _computing_publication_material ? _refine_special_details ; Refinement on F^2^ for ALL reflections except for 0 with very negative F^2^ or flagged by the user for potential systematic errors. Weighted R-factors wR and all goodnesses of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The observed criterion of F^2^ > 2sigma(F^2^) is used only for calculating _R_factor_obs etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ 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 w=1/[\s^2^(Fo^2^)+(0.1145P)^2^+4.9381P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment ? _refine_ls_extinction_method SHELXL _refine_ls_extinction_coef 0.0022(4) _refine_ls_extinction_expression 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^' _refine_ls_number_reflns 1086 _refine_ls_number_parameters 94 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0668 _refine_ls_R_factor_obs 0.0642 _refine_ls_wR_factor_all 0.1930 _refine_ls_wR_factor_obs 0.1884 _refine_ls_goodness_of_fit_all 1.113 _refine_ls_goodness_of_fit_obs 1.116 _refine_ls_restrained_S_all 1.113 _refine_ls_restrained_S_obs 1.116 _refine_ls_shift/esd_max 0.000 _refine_ls_shift/esd_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_thermal_displace_type _atom_site_occupancy _atom_site_calc_flag _atom_site_refinement_flags _atom_site_disorder_group Ag1 Ag -0.13376(4) 0.72493(11) 0.36762(3) 0.0578(2) Uani 1 d . . Ag2 Ag 0.0000 0.2152(2) 0.2500 0.0592(2) Uani 1 d S . Ag3 Ag 0.2500 0.2500 0.5000 0.0529(2) Uani 1 d S . S1 S -0.06794(10) 0.2327(3) 0.35774(9) 0.0434(4) Uani 1 d . . C1 C 0.0301(4) 0.2400(11) 0.4342(4) 0.0445(15) Uani 1 d . . N1 N 0.0974(4) 0.2464(9) 0.4882(3) 0.0476(15) Uani 1 d . . Cl1 Cl -0.31939(9) 1.1920(3) 0.34240(8) 0.0456(4) Uani 1 d . . O1 O -0.4141(3) 1.2504(9) 0.3299(3) 0.064(2) Uani 1 d . . O2 O -0.2623(3) 1.2862(10) 0.4177(3) 0.063(2) Uani 1 d . . O3 O -0.2907(3) 1.3140(10) 0.2843(3) 0.0583(13) Uani 1 d . . O4 O -0.3076(3) 0.8857(10) 0.3403(3) 0.0627(12) Uani 1 d . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Ag1 0.0543(3) 0.0596(3) 0.0540(3) 0.0004(2) 0.0113(2) 0.0050(2) Ag2 0.0559(4) 0.0775(5) 0.0453(4) 0.000 0.0188(3) 0.000 Ag3 0.0372(3) 0.0700(5) 0.0476(4) 0.0026(2) 0.0094(3) 0.0035(2) S1 0.0323(6) 0.0534(9) 0.0412(7) -0.0003(5) 0.0082(5) 0.0007(5) C1 0.041(3) 0.053(3) 0.043(3) -0.005(2) 0.018(2) 0.001(2) N1 0.037(2) 0.051(3) 0.048(3) 0.000(2) 0.005(2) -0.002(2) Cl1 0.0365(6) 0.0568(8) 0.0415(7) 0.0014(5) 0.0107(5) 0.0029(5) O1 0.030(2) 0.075(3) 0.090(4) 0.018(2) 0.025(2) 0.012(2) O2 0.058(3) 0.081(3) 0.040(2) -0.009(2) 0.004(2) 0.001(2) O3 0.054(2) 0.062(3) 0.061(2) 0.005(2) 0.022(2) -0.001(2) O4 0.067(2) 0.048(3) 0.076(2) -0.003(2) 0.028(2) -0.005(2) _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 Ag1 N1 2.505(6) 5_566 ? Ag1 S1 2.583(2) . ? Ag1 S1 2.651(2) 1_565 ? Ag2 S1 2.521(2) . ? Ag2 S1 2.521(2) 2 ? Ag3 N1 2.270(6) . ? Ag3 N1 2.270(6) 7_556 ? S1 C1 1.666(6) . ? S1 Ag1 2.651(2) 1_545 ? C1 N1 1.160(8) . ? N1 Ag1 2.505(6) 5_566 ? Cl1 O3 1.406(5) . ? Cl1 O1 1.415(4) . ? Cl1 O2 1.428(4) . ? Cl1 O4 1.473(5) . ? 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 N1 Ag1 S1 99.84(11) 5_566 . ? N1 Ag1 S1 93.92(11) 5_566 1_565 ? S1 Ag1 S1 131.16(7) . 1_565 ? S1 Ag2 S1 176.20(7) . 2 ? N1 Ag3 N1 180.000(1) . 7_556 ? C1 S1 Ag2 99.4(2) . . ? C1 S1 Ag1 100.6(2) . . ? Ag2 S1 Ag1 111.02(6) . . ? C1 S1 Ag1 102.5(2) . 1_545 ? Ag2 S1 Ag1 106.86(6) . 1_545 ? Ag1 S1 Ag1 131.16(7) . 1_545 ? N1 C1 S1 178.8(6) . . ? C1 N1 Ag3 131.9(6) . . ? C1 N1 Ag1 135.4(5) . 5_566 ? Ag3 N1 Ag1 92.7(2) . 5_566 ? O3 Cl1 O1 111.2(3) . . ? O3 Cl1 O2 110.6(3) . . ? O1 Cl1 O2 110.5(3) . . ? O3 Cl1 O4 108.5(3) . . ? O1 Cl1 O4 108.6(3) . . ? O2 Cl1 O4 107.3(3) . . ? _refine_diff_density_max 1.356 _refine_diff_density_min -1.479 _refine_diff_density_rms 0.260