#------------------------------------------------------------------------------ #$Date: 2020-04-28 01:37:23 +0300 (Tue, 28 Apr 2020) $ #$Revision: 251199 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/24/04/7240408.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_7240408 loop_ _publ_author_name 'Kusakawa, Takumi' 'Goto, Takayuki' 'Hori, Akiko' _publ_section_title ; Supramolecular association of M2+⋯\p induced by different electrostatic properties using naphthyl substituted \b-diketonate complexes (metal = Cu, Pd, Pt) ; _journal_name_full CrystEngComm _journal_paper_doi 10.1039/D0CE00416B _journal_year 2020 _chemical_formula_moiety 'C46 H30 O4 Pt' _chemical_formula_sum 'C46 H30 O4 Pt' _chemical_formula_weight 841.79 _space_group_crystal_system monoclinic _space_group_IT_number 14 _space_group_name_Hall '-P 2yn' _space_group_name_H-M_alt 'P 1 21/n 1' _atom_sites_solution_hydrogens geom _audit_creation_method 'APEX3 v2018.7-2' _audit_update_record ; 2020-02-18 deposited with the CCDC. 2020-04-14 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 97.217(5) _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 15.8989(17) _cell_length_b 6.0142(6) _cell_length_c 17.7912(19) _cell_measurement_reflns_used 124 _cell_measurement_temperature 200 _cell_measurement_theta_max 35.4294 _cell_measurement_theta_min 0.0688 _cell_volume 1687.7(3) _computing_cell_refinement 'APEX3 v2018.7-2 (Bruker AXS)' _computing_data_collection 'Bruker Instrument Service vV6.2.6' _computing_data_reduction 'SAINT V8.38A (Bruker AXS Inc., 2017)' _computing_molecular_graphics 'shelXle (C.B. Huebschle, rev 924)' _computing_structure_refinement 'SHELXL-2018/3 (Sheldrick, 2018)' _computing_structure_solution 'SHELXT 2014/5 (Sheldrick, 2014)' _diffrn_ambient_temperature 200 _diffrn_detector_area_resol_mean 7.3910 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.999 _diffrn_measurement_device_type 'Bruker D8 Goniometer' _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.1606 _diffrn_reflns_av_unetI/netI 0.1039 _diffrn_reflns_limit_h_max 18 _diffrn_reflns_limit_h_min -18 _diffrn_reflns_limit_k_max 7 _diffrn_reflns_limit_k_min -7 _diffrn_reflns_limit_l_max 21 _diffrn_reflns_limit_l_min -21 _diffrn_reflns_number 21540 _diffrn_reflns_theta_full 25.02 _diffrn_reflns_theta_max 25.02 _diffrn_reflns_theta_min 2.31 _exptl_absorpt_coefficient_mu 4.204 _exptl_absorpt_correction_T_max 0.89 _exptl_absorpt_correction_T_min 0.77 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction ; _exptl_crystal_colour orange _exptl_crystal_density_diffrn 1.656 _exptl_crystal_density_method 'not measured' _exptl_crystal_description prismatic _exptl_crystal_F_000 832 _exptl_crystal_size_max 0.067 _exptl_crystal_size_mid 0.044 _exptl_crystal_size_min 0.028 _refine_diff_density_max 0.573 _refine_diff_density_min -0.767 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.032 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 232 _refine_ls_number_reflns 2980 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.032 _refine_ls_R_factor_all 0.0962 _refine_ls_R_factor_gt 0.0458 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0170P)^2^] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0728 _refine_ls_wR_factor_ref 0.0912 _reflns_number_gt 1816 _reflns_number_total 2980 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file d0ce00416b2.cif _cod_data_source_block 'global_CCDC1' _cod_depositor_comments ; The following automatic conversions were performed: data item '_exptl_absorpt_correction_type' value 'Multi-Scan' was changed to 'multi-scan' in accordance with the /home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic dictionary named 'cif_core.dic' version 2.4.2 last updated on 2011-04-26. Automatic conversion script Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas ; _cod_database_code 7240408 _shelx_shelxl_version_number 2016/6 _shelx_res_file ; TITL P21n_b.res in P2(1)/n P21n_b.res created by SHELXL-2018/3 at 15:47:48 on 17-Feb-2020 REM Old TITL P21n in P2(1)/n REM SHELXT solution in P2(1)/n REM R1 0.191, Rweak 0.006, Alpha 0.078, Orientation as input REM Formula found by SHELXT: C62 O2 Pt CELL 0.71073 15.8989 6.0142 17.7912 90.000 97.217 90.000 ZERR 2.000 0.0017 0.0006 0.0019 0.000 0.005 0.000 LATT 1 SYMM 1/2-X, 1/2+Y, 1/2-Z SFAC C H O PT UNIT 92 60 8 2 TEMP -73.130 L.S. 10 BOND $H LIST 6 shel 20 0.84 size 0.067 0.044 0.028 acta FMAP 2 PLAN 20 WGHT 0.017000 FVAR 0.31397 C1 1 0.603886 0.688891 0.727579 11.00000 0.02747 0.02086 = 0.03756 0.01235 0.00246 0.00862 AFIX 43 H1 2 0.577877 0.830626 0.719767 11.00000 -1.20000 AFIX 0 C2 1 0.631986 0.616716 0.803135 11.00000 0.03487 0.03485 = 0.02919 -0.00131 0.01962 -0.00930 C3 1 0.625239 0.754880 0.866234 11.00000 0.05425 0.03182 = 0.04131 -0.00257 0.01775 -0.00200 AFIX 43 H3 2 0.597509 0.894604 0.859130 11.00000 -1.20000 AFIX 0 C4 1 0.658227 0.689538 0.937454 11.00000 0.05819 0.03829 = 0.03108 -0.01527 0.00764 -0.01182 AFIX 43 H4 2 0.655732 0.785606 0.979503 11.00000 -1.20000 AFIX 0 C5 1 0.695480 0.480759 0.947620 11.00000 0.05373 0.05162 = 0.02436 0.00485 0.00158 0.00268 AFIX 43 H5 2 0.718215 0.435234 0.997163 11.00000 -1.20000 AFIX 0 C6 1 0.700223 0.339562 0.888254 11.00000 0.03781 0.03405 = 0.04179 0.01587 0.00922 0.00465 AFIX 43 H6 2 0.724854 0.196682 0.897468 11.00000 -1.20000 AFIX 0 C7 1 0.669044 0.402278 0.813046 11.00000 0.03484 0.03014 = 0.03335 0.01349 0.01145 -0.00116 C8 1 0.673945 0.268773 0.749714 11.00000 0.03866 0.02658 = 0.02916 -0.00545 0.00175 0.00557 AFIX 43 H8 2 0.695801 0.122092 0.756311 11.00000 -1.20000 REM ##### AFIX 0 C9 1 0.647926 0.345126 0.678561 11.00000 0.03243 0.03710 = 0.02052 -0.00076 0.00551 -0.00421 AFIX 43 H9 2 0.653151 0.251756 0.636327 11.00000 -1.20000 AFIX 0 C10 1 0.613611 0.558490 0.666318 11.00000 0.02048 0.03889 = 0.02914 0.00251 0.00590 0.00171 C11 1 0.587038 0.650592 0.589088 11.00000 0.03512 0.02429 = 0.03194 0.00029 -0.00441 -0.01375 C12 1 0.610179 0.551914 0.524513 11.00000 0.02986 0.02899 = 0.02706 0.00270 -0.00064 0.00028 AFIX 43 H12 2 0.642495 0.419141 0.532133 11.00000 -1.20000 AFIX 0 C13 1 0.591842 0.623596 0.449014 11.00000 0.03183 0.01995 = 0.03626 0.00007 0.00623 0.00209 C14 1 0.616753 0.493509 0.384436 11.00000 0.02239 0.03134 = 0.02992 0.00465 0.00149 0.00594 C15 1 0.659897 0.286847 0.392749 11.00000 0.03706 0.02979 = 0.04289 0.00691 -0.00507 0.00327 AFIX 43 H15 2 0.678238 0.232035 0.442174 11.00000 -1.20000 AFIX 0 C16 1 0.675501 0.166145 0.331931 11.00000 0.03517 0.02796 = 0.05287 -0.00215 0.01406 0.01144 AFIX 43 H16 2 0.704782 0.028758 0.339738 11.00000 -1.20000 AFIX 0 C17 1 0.649367 0.238894 0.256719 11.00000 0.04628 0.03379 = 0.03284 -0.00420 0.01365 -0.00088 C18 1 0.662485 0.119283 0.191592 11.00000 0.05658 0.05019 = 0.05179 -0.01093 0.01782 -0.00084 AFIX 43 H18 2 0.692297 -0.017798 0.197252 11.00000 -1.20000 AFIX 0 C19 1 0.634522 0.191221 0.121683 11.00000 0.06883 0.05513 = 0.05140 -0.02595 0.01744 -0.00673 AFIX 43 H19 2 0.642953 0.103772 0.078795 11.00000 -1.20000 AFIX 0 C20 1 0.592543 0.397311 0.112157 11.00000 0.05321 0.06921 = 0.02186 -0.01062 0.00827 -0.00559 AFIX 43 H20 2 0.573276 0.449288 0.062552 11.00000 -1.20000 AFIX 0 C21 1 0.579280 0.522596 0.173019 11.00000 0.03796 0.05792 = 0.03578 0.00536 0.00634 0.00283 AFIX 43 H21 2 0.550775 0.661174 0.165563 11.00000 -1.20000 AFIX 0 C22 1 0.607446 0.448999 0.247391 11.00000 0.03353 0.04844 = 0.03547 0.00301 0.00683 -0.00190 C23 1 0.592593 0.571814 0.312619 11.00000 0.02683 0.03937 = 0.03939 0.00303 0.00079 0.00178 AFIX 43 H23 2 0.565158 0.712107 0.306300 11.00000 -1.20000 AFIX 0 O1 3 0.545701 0.832979 0.590839 11.00000 0.05223 0.02501 = 0.02481 -0.00108 -0.00044 0.00247 O2 3 0.549765 0.800057 0.429744 11.00000 0.04661 0.03190 = 0.02242 0.00386 0.00566 0.01436 PT1 4 0.500000 1.000000 0.500000 10.50000 0.04309 0.02867 = 0.02846 0.00000 0.00241 0.00413 HKLF 4 REM P21n_b.res in P2(1)/n REM wR2 = 0.091175, GooF = S = 1.03172, Restrained GooF = 1.03172 for all data REM R1 = 0.045819 for 1816 Fo > 4sig(Fo) and 0.096174 for all 2980 data REM 232 parameters refined using 0 restraints END WGHT 0.0170 0.0000 REM Highest difference peak 0.573, deepest hole -0.767, 1-sigma level 0.146 Q1 1 0.6587 0.0149 0.5791 11.00000 0.05 0.57 Q2 1 0.6755 0.5004 0.8136 11.00000 0.05 0.57 Q3 1 0.4618 0.8333 0.5594 11.00000 0.05 0.55 Q4 1 0.5376 0.9420 0.5807 11.00000 0.05 0.54 Q5 1 0.5462 1.0005 0.9264 11.00000 0.05 0.53 Q6 1 0.7344 -0.0124 0.2208 11.00000 0.05 0.51 Q7 1 0.6619 0.3381 0.8410 11.00000 0.05 0.50 Q8 1 0.6609 0.7547 0.4013 11.00000 0.05 0.50 Q9 1 0.5612 0.1893 0.0612 11.00000 0.05 0.49 Q10 1 0.6969 0.7807 0.8770 11.00000 0.05 0.48 Q11 1 0.5897 0.7516 0.4523 11.00000 0.05 0.47 Q12 1 0.6961 0.2691 0.2595 11.00000 0.05 0.47 Q13 1 0.6933 0.3561 0.7825 11.00000 0.05 0.46 Q14 1 0.5212 0.9137 0.8639 11.00000 0.05 0.46 Q15 1 0.6377 0.6693 0.6821 11.00000 0.05 0.45 Q16 1 0.6789 0.8176 0.7191 11.00000 0.05 0.45 Q17 1 0.6590 0.4193 0.3838 11.00000 0.05 0.45 Q18 1 0.4807 0.6512 0.1415 11.00000 0.05 0.44 Q19 1 0.5305 0.3741 0.6432 11.00000 0.05 0.43 Q20 1 0.7013 0.9984 0.9780 11.00000 0.05 0.43 ; _shelx_res_checksum 85003 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, -y-1/2, z-1/2' loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy _atom_site_refinement_flags_posn _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group C C1 0.6039(5) 0.6889(14) 0.7276(5) 0.029(2) Uani d . . . 1 . . H H1 0.577877 0.830626 0.719767 0.035 Uiso calc U . R 1 . . C C2 0.6320(6) 0.6167(17) 0.8031(5) 0.032(3) Uani d . . . 1 . . C C3 0.6252(6) 0.7549(15) 0.8662(5) 0.041(3) Uani d . . . 1 . . H H3 0.597509 0.894604 0.85913 0.05 Uiso calc U . R 1 . . C C4 0.6582(6) 0.6895(16) 0.9375(5) 0.042(3) Uani d . . . 1 . . H H4 0.655732 0.785606 0.979503 0.051 Uiso calc U . R 1 . . C C5 0.6955(5) 0.481(2) 0.9476(5) 0.044(2) Uani d . . . 1 . . H H5 0.718215 0.435234 0.997163 0.052 Uiso calc U . R 1 . . C C6 0.7002(5) 0.3396(15) 0.8883(5) 0.038(2) Uani d . . . 1 . . H H6 0.724854 0.196682 0.897468 0.045 Uiso calc U . R 1 . . C C7 0.6690(6) 0.4023(16) 0.8130(5) 0.032(3) Uani d . . . 1 . . C C8 0.6739(5) 0.2688(14) 0.7497(5) 0.032(2) Uani d . . . 1 . . H H8 0.695801 0.122092 0.756311 0.038 Uiso calc U . R 1 . . C C9 0.6479(5) 0.3451(15) 0.6786(5) 0.030(2) Uani d . . . 1 . . H H9 0.653151 0.251756 0.636327 0.036 Uiso calc U . R 1 . . C C10 0.6136(5) 0.5585(14) 0.6663(5) 0.029(3) Uani d . . . 1 . . C C11 0.5870(6) 0.6506(14) 0.5891(5) 0.031(2) Uani d . . . 1 . . C C12 0.6102(5) 0.5519(13) 0.5245(4) 0.029(2) Uani d . . . 1 . . H H12 0.642495 0.419141 0.532133 0.035 Uiso calc U . R 1 . . C C13 0.5918(5) 0.6236(13) 0.4490(5) 0.029(2) Uani d . . . 1 . . C C14 0.6168(4) 0.4935(19) 0.3844(4) 0.0280(17) Uani d . . . 1 . . C C15 0.6599(5) 0.2868(14) 0.3927(5) 0.037(2) Uani d . . . 1 . . H H15 0.678238 0.232035 0.442174 0.045 Uiso calc U . R 1 . . C C16 0.6755(5) 0.1661(15) 0.3319(5) 0.038(2) Uani d . . . 1 . . H H16 0.704782 0.028758 0.339738 0.046 Uiso calc U . R 1 . . C C17 0.6494(6) 0.2389(15) 0.2567(5) 0.037(2) Uani d . . . 1 . . C C18 0.6625(6) 0.1193(17) 0.1916(6) 0.052(3) Uani d . . . 1 . . H H18 0.692297 -0.017798 0.197252 0.062 Uiso calc U . R 1 . . C C19 0.6345(7) 0.1912(18) 0.1217(6) 0.058(3) Uani d . . . 1 . . H H19 0.642953 0.103772 0.078795 0.069 Uiso calc U . R 1 . . C C20 0.5925(6) 0.3973(17) 0.1122(5) 0.048(3) Uani d . . . 1 . . H H20 0.573276 0.449288 0.062552 0.057 Uiso calc U . R 1 . . C C21 0.5793(5) 0.523(2) 0.1730(4) 0.044(2) Uani d . . . 1 . . H H21 0.550775 0.661174 0.165563 0.052 Uiso calc U . R 1 . . C C22 0.6074(5) 0.4490(16) 0.2474(5) 0.039(3) Uani d . . . 1 . . C C23 0.5926(5) 0.5718(14) 0.3126(5) 0.035(3) Uani d . . . 1 . . H H23 0.565158 0.712107 0.3063 0.043 Uiso calc U . R 1 . . O O1 0.5457(4) 0.8330(9) 0.5908(3) 0.0345(16) Uani d . . . 1 . . O O2 0.5498(4) 0.8001(9) 0.4297(3) 0.0335(16) Uani d . . . 1 . . Pt Pt1 0.5 1.0 0.5 0.03358(16) Uani d . P S 1 . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 C1 0.027(6) 0.021(5) 0.038(6) 0.009(4) 0.002(5) 0.012(4) C2 0.035(6) 0.035(6) 0.029(6) -0.009(5) 0.020(5) -0.001(5) C3 0.054(7) 0.032(6) 0.041(6) -0.002(5) 0.018(5) -0.003(5) C4 0.058(7) 0.038(6) 0.031(6) -0.012(6) 0.008(5) -0.015(5) C5 0.054(6) 0.052(7) 0.024(5) 0.003(7) 0.002(4) 0.005(7) C6 0.038(6) 0.034(6) 0.042(6) 0.005(5) 0.009(5) 0.016(5) C7 0.035(6) 0.030(5) 0.033(6) -0.001(5) 0.011(5) 0.013(5) C8 0.039(6) 0.027(5) 0.029(5) 0.006(5) 0.002(5) -0.005(4) C9 0.032(6) 0.037(6) 0.021(5) -0.004(5) 0.006(4) -0.001(5) C10 0.020(5) 0.039(8) 0.029(5) 0.002(4) 0.006(4) 0.003(4) C11 0.035(6) 0.024(5) 0.032(5) -0.014(4) -0.004(5) 0.000(4) C12 0.030(5) 0.029(7) 0.027(5) 0.000(4) -0.001(4) 0.003(4) C13 0.032(6) 0.020(5) 0.036(6) 0.002(4) 0.006(5) 0.000(4) C14 0.022(4) 0.031(4) 0.030(4) 0.006(6) 0.001(3) 0.005(7) C15 0.037(6) 0.030(6) 0.043(6) 0.003(5) -0.005(5) 0.007(5) C16 0.035(6) 0.028(5) 0.053(7) 0.011(5) 0.014(5) -0.002(5) C17 0.046(7) 0.034(6) 0.033(6) -0.001(5) 0.014(5) -0.004(5) C18 0.057(8) 0.050(7) 0.052(7) -0.001(6) 0.018(6) -0.011(6) C19 0.069(9) 0.055(8) 0.051(7) -0.007(7) 0.017(7) -0.026(6) C20 0.053(7) 0.069(8) 0.022(5) -0.006(6) 0.008(5) -0.011(5) C21 0.038(5) 0.058(7) 0.036(5) 0.003(7) 0.006(4) 0.005(7) C22 0.034(5) 0.048(9) 0.035(5) -0.002(5) 0.007(4) 0.003(5) C23 0.027(5) 0.039(7) 0.039(6) 0.002(4) 0.001(4) 0.003(4) O1 0.052(4) 0.025(4) 0.025(3) 0.002(3) 0.000(3) -0.001(3) O2 0.047(4) 0.032(4) 0.022(3) 0.014(3) 0.006(3) 0.004(3) Pt1 0.0431(3) 0.0287(3) 0.0285(3) 0.0041(4) 0.0024(2) 0.0000(4) 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' H H 0.0000 0.0000 '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' Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag C10 C1 C2 . . 121.5(8) ? C10 C1 H1 . . 119.3 ? C2 C1 H1 . . 119.3 ? C3 C2 C7 . . 120.5(10) ? C3 C2 C1 . . 121.5(9) ? C7 C2 C1 . . 117.9(9) ? C4 C3 C2 . . 120.6(9) ? C4 C3 H3 . . 119.7 ? C2 C3 H3 . . 119.7 ? C3 C4 C5 . . 119.2(9) ? C3 C4 H4 . . 120.4 ? C5 C4 H4 . . 120.4 ? C6 C5 C4 . . 121.7(8) ? C6 C5 H5 . . 119.2 ? C4 C5 H5 . . 119.2 ? C5 C6 C7 . . 121.2(9) ? C5 C6 H6 . . 119.4 ? C7 C6 H6 . . 119.4 ? C8 C7 C6 . . 124.1(9) ? C8 C7 C2 . . 119.2(9) ? C6 C7 C2 . . 116.7(10) ? C9 C8 C7 . . 121.1(9) ? C9 C8 H8 . . 119.5 ? C7 C8 H8 . . 119.5 ? C8 C9 C10 . . 121.4(9) ? C8 C9 H9 . . 119.3 ? C10 C9 H9 . . 119.3 ? C1 C10 C9 . . 118.8(8) ? C1 C10 C11 . . 118.3(8) ? C9 C10 C11 . . 122.9(8) ? O1 C11 C12 . . 125.3(8) ? O1 C11 C10 . . 112.5(8) ? C12 C11 C10 . . 122.1(8) ? C11 C12 C13 . . 128.1(8) ? C11 C12 H12 . . 116.0 ? C13 C12 H12 . . 116.0 ? O2 C13 C12 . . 123.3(8) ? O2 C13 C14 . . 114.3(8) ? C12 C13 C14 . . 122.3(8) ? C23 C14 C15 . . 118.3(8) ? C23 C14 C13 . . 118.0(9) ? C15 C14 C13 . . 123.6(8) ? C16 C15 C14 . . 121.5(8) ? C16 C15 H15 . . 119.3 ? C14 C15 H15 . . 119.3 ? C15 C16 C17 . . 121.9(8) ? C15 C16 H16 . . 119.1 ? C17 C16 H16 . . 119.1 ? C18 C17 C16 . . 124.4(9) ? C18 C17 C22 . . 118.3(9) ? C16 C17 C22 . . 117.3(8) ? C19 C18 C17 . . 122.4(10) ? C19 C18 H18 . . 118.8 ? C17 C18 H18 . . 118.8 ? C18 C19 C20 . . 119.6(10) ? C18 C19 H19 . . 120.2 ? C20 C19 H19 . . 120.2 ? C21 C20 C19 . . 120.8(10) ? C21 C20 H20 . . 119.6 ? C19 C20 H20 . . 119.6 ? C20 C21 C22 . . 120.7(11) ? C20 C21 H21 . . 119.7 ? C22 C21 H21 . . 119.7 ? C21 C22 C23 . . 122.4(9) ? C21 C22 C17 . . 118.3(9) ? C23 C22 C17 . . 119.2(8) ? C14 C23 C22 . . 121.8(9) ? C14 C23 H23 . . 119.1 ? C22 C23 H23 . . 119.1 ? C11 O1 Pt1 . . 123.8(6) ? C13 O2 Pt1 . . 125.1(5) ? O1 Pt1 O1 3_676 . 180.0 ? O1 Pt1 O2 3_676 . 85.8(2) ? O1 Pt1 O2 . . 94.2(2) ? O1 Pt1 O2 3_676 3_676 94.2(2) ? O1 Pt1 O2 . 3_676 85.8(2) ? O2 Pt1 O2 . 3_676 180.0 ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag C1 C10 . 1.367(10) ? C1 C2 . 1.430(11) ? C1 H1 . 0.95 ? C2 C3 . 1.412(11) ? C2 C7 . 1.420(11) ? C3 C4 . 1.367(11) ? C3 H3 . 0.95 ? C4 C5 . 1.390(13) ? C4 H4 . 0.95 ? C5 C6 . 1.365(11) ? C5 H5 . 0.95 ? C6 C7 . 1.418(11) ? C6 H6 . 0.95 ? C7 C8 . 1.394(11) ? C8 C9 . 1.361(10) ? C8 H8 . 0.95 ? C9 C10 . 1.401(11) ? C9 H9 . 0.95 ? C10 C11 . 1.492(11) ? C11 O1 . 1.281(10) ? C11 C12 . 1.383(10) ? C12 C13 . 1.406(10) ? C12 H12 . 0.95 ? C13 O2 . 1.278(9) ? C13 C14 . 1.484(11) ? C14 C23 . 1.371(10) ? C14 C15 . 1.418(12) ? C15 C16 . 1.352(11) ? C15 H15 . 0.95 ? C16 C17 . 1.419(11) ? C16 H16 . 0.95 ? C17 C18 . 1.402(11) ? C17 C22 . 1.429(12) ? C18 C19 . 1.339(12) ? C18 H18 . 0.95 ? C19 C20 . 1.408(13) ? C19 H19 . 0.95 ? C20 C21 . 1.357(11) ? C20 H20 . 0.95 ? C21 C22 . 1.414(11) ? C21 H21 . 0.95 ? C22 C23 . 1.420(11) ? C23 H23 . 0.95 ? O1 Pt1 . 1.963(6) ? O2 Pt1 . 1.970(5) ?