#------------------------------------------------------------------------------ #$Date: 2012-05-05 15:52:45 +0300 (Sat, 05 May 2012) $ #$Revision: 55703 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/23/44/2234426.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2234426 loop_ _publ_author_name 'Ha, Kwang' _publ_section_title ; cis-(Di-2-pyridylamine-\k^2^N^2^,N^2'^)bis(thiocyanato-\kS)platinum(II) ; _journal_coeditor_code TK5067 _journal_issue 4 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m440 _journal_volume 68 _journal_year 2012 _chemical_formula_iupac '[Pt (N C S)2 (C10 H9 N3)]' _chemical_formula_moiety 'C12 H9 N5 Pt S2' _chemical_formula_sum 'C12 H9 N5 Pt S2' _chemical_formula_weight 482.45 _chemical_name_systematic ; cis-(Di-2-pyridylamine-\k^2^N^2^,N^2'^)bis(thiocyanato- \kS)platinum(II) ; _space_group_IT_number 2 _symmetry_cell_setting triclinic _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _cell_angle_alpha 94.292(2) _cell_angle_beta 93.081(2) _cell_angle_gamma 106.123(2) _cell_formula_units_Z 2 _cell_length_a 7.2282(6) _cell_length_b 9.8308(8) _cell_length_c 10.2501(8) _cell_measurement_reflns_used 3201 _cell_measurement_temperature 200(2) _cell_measurement_theta_max 25.94 _cell_measurement_theta_min 2.81 _cell_volume 695.64(10) _computing_cell_refinement 'SAINT (Bruker, 2000)' _computing_data_collection 'SMART (Bruker, 2000)' _computing_data_reduction 'SAINT (Bruker, 2000)' _computing_molecular_graphics 'ORTEP-3 (Farrugia, 1997) and PLATON (Spek, 2009)' _computing_publication_material 'SHELXL97 (Sheldrick, 2008)' _computing_structure_refinement 'SHELXL97 (Sheldrick, 2008)' _computing_structure_solution 'SHELXS97 (Sheldrick, 2008)' _diffrn_ambient_temperature 200(2) _diffrn_measured_fraction_theta_full 0.969 _diffrn_measured_fraction_theta_max 0.969 _diffrn_measurement_device_type 'Bruker SMART 1000 CCD' _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_monochromator graphite _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0177 _diffrn_reflns_av_sigmaI/netI 0.0327 _diffrn_reflns_limit_h_max 8 _diffrn_reflns_limit_h_min -8 _diffrn_reflns_limit_k_max 11 _diffrn_reflns_limit_k_min -12 _diffrn_reflns_limit_l_max 12 _diffrn_reflns_limit_l_min -12 _diffrn_reflns_number 4195 _diffrn_reflns_theta_full 26.00 _diffrn_reflns_theta_max 26.00 _diffrn_reflns_theta_min 2.00 _diffrn_standards_decay_% 0 _diffrn_standards_interval_count 0 _diffrn_standards_interval_time 0 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 10.381 _exptl_absorpt_correction_T_max 1.000000 _exptl_absorpt_correction_T_min 0.811495 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details '(SADABS; Bruker, 2000)' _exptl_crystal_colour yellow _exptl_crystal_density_diffrn 2.303 _exptl_crystal_density_method 'not measured' _exptl_crystal_description block _exptl_crystal_F_000 452 _exptl_crystal_size_max 0.19 _exptl_crystal_size_mid 0.15 _exptl_crystal_size_min 0.09 _refine_diff_density_max 3.963 _refine_diff_density_min -1.397 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.218 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 181 _refine_ls_number_reflns 2636 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.218 _refine_ls_R_factor_all 0.0392 _refine_ls_R_factor_gt 0.0313 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'calc w=1/[\s^2^(Fo^2^)+(0.0179P)^2^+8.2228P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0706 _refine_ls_wR_factor_ref 0.0880 _reflns_number_gt 2391 _reflns_number_total 2636 _reflns_threshold_expression I>2\s(I) _iucr_refine_instructions_details ; TITL [Pt(SCN)2(dpa)] CELL 0.71073 7.2282 9.8308 10.2501 94.292 93.081 106.123 ZERR 2.00 0.0006 0.0008 0.0008 0.002 0.002 0.002 LATT 1 SFAC C H N Pt S UNIT 24 18 10 2 4 MERG 2 L.S. 18 OMIT -8 7 2 OMIT 0 -11 4 OMIT -7 8 4 OMIT 2 -9 9 OMIT -7 0 8 OMIT 7 -5 7 OMIT 8 -7 3 OMIT -8 8 0 OMIT 0 -9 8 OMIT 7 -4 7 OMIT -6 8 6 OMIT 8 -6 3 OMIT -5 7 8 OMIT -4 7 9 OMIT 3 1 11 OMIT -6 -6 2 OMIT 8 -8 1 OMIT 8 -7 1 OMIT 1 -9 9 OMIT 0 10 5 OMIT 7 -7 5 OMIT -2 4 11 OMIT -8 -1 4 OMIT -4 8 8 OMIT 8 -7 2 OMIT -2 5 11 OMIT 3 -2 11 OMIT 1 10 4 OMIT -2 11 4 ACTA BOND $H CONF EQIV $1 x,-1+y,z HTAB N2 N5_$1 HTAB C10 S2 MPLA 6 N1 C1 C2 C3 C4 C5 MPLA 6 N3 C6 C7 C8 C9 C10 FMAP 2 PLAN -20 TEMP -73 WGHT 0.017900 8.222800 FVAR 0.41597 PT1 4 1.016711 0.505725 0.268929 11.00000 0.03115 0.02336 = 0.03124 0.00443 0.00534 0.01455 S1 5 1.309666 0.676714 0.272027 11.00000 0.03371 0.02976 = 0.04111 -0.00085 -0.00072 0.00938 S2 5 0.928430 0.644509 0.431423 11.00000 0.05727 0.02848 = 0.03190 0.00644 0.01316 0.02203 N1 3 1.097072 0.369886 0.134419 11.00000 0.02510 0.01680 = 0.03592 0.00263 0.00468 0.00714 N2 3 0.942560 0.176054 0.252402 11.00000 0.03894 0.02299 = 0.03434 0.00623 0.00646 0.01389 AFIX 3 H2N 2 0.946361 0.090088 0.280498 11.00000 -1.50000 AFIX 0 N3 3 0.766670 0.344521 0.284522 11.00000 0.02547 0.02115 = 0.02872 0.00894 0.00401 0.00328 N4 3 1.271859 0.829474 0.053527 11.00000 0.03117 0.03284 = 0.06448 0.01446 0.00533 0.00642 N5 3 0.960481 0.906945 0.329148 11.00000 0.09951 0.02786 = 0.06596 0.01771 0.03001 0.03315 C1 1 1.205851 0.416218 0.035014 11.00000 0.02732 0.02530 = 0.03788 0.00202 0.00501 0.01172 AFIX 43 H1 2 1.224713 0.511928 0.015720 11.00000 -1.20000 AFIX 0 C2 1 1.289033 0.333550 -0.038228 11.00000 0.04108 0.03702 = 0.02818 -0.00229 0.00692 0.00715 AFIX 43 H2 2 1.363326 0.369830 -0.108149 11.00000 -1.20000 AFIX 0 C3 1 1.263465 0.192347 -0.008896 11.00000 0.02989 0.04604 = 0.05321 -0.00242 0.00706 0.02030 AFIX 43 H3 2 1.323411 0.132170 -0.056998 11.00000 -1.20000 AFIX 0 C4 1 1.152038 0.143731 0.088996 11.00000 0.03851 0.02090 = 0.03909 -0.00711 -0.01218 0.00667 AFIX 43 H4 2 1.135056 0.049004 0.110743 11.00000 -1.20000 AFIX 0 C5 1 1.061908 0.231488 0.158238 11.00000 0.02467 0.02057 = 0.03705 -0.00299 -0.00270 0.01000 C6 1 0.778383 0.210502 0.287249 11.00000 0.03889 0.03856 = 0.02792 0.00312 0.00091 0.01470 C7 1 0.628569 0.104011 0.328461 11.00000 0.03317 0.02758 = 0.04393 0.00987 0.00367 -0.00766 AFIX 43 H7 2 0.640142 0.010394 0.331877 11.00000 -1.20000 AFIX 0 C8 1 0.465202 0.135264 0.363850 11.00000 0.03532 0.05632 = 0.04244 0.01028 0.00713 -0.00663 AFIX 43 H8 2 0.361944 0.063574 0.392513 11.00000 -1.20000 AFIX 0 C9 1 0.449968 0.274272 0.357780 11.00000 0.03242 0.06809 = 0.02547 -0.01123 -0.00611 0.01813 AFIX 43 H9 2 0.336893 0.298036 0.381835 11.00000 -1.20000 AFIX 0 C10 1 0.601137 0.373575 0.316636 11.00000 0.02181 0.04710 = 0.03990 0.00462 0.00371 0.01427 AFIX 43 H10 2 0.590551 0.467048 0.310085 11.00000 -1.20000 AFIX 0 C11 1 1.282549 0.767282 0.141391 11.00000 0.03087 0.02404 = 0.05004 0.00588 0.01100 0.00762 C12 1 0.948582 0.799414 0.367826 11.00000 0.03633 0.02717 = 0.03820 0.00259 0.00932 0.01201 HKLF 4 REM [Pt(SCN)2(dpa)] REM R1 = 0.0313 for 2391 Fo > 4sig(Fo) and 0.0392 for all 2636 data REM 181 parameters refined using 0 restraints END WGHT 0.0179 8.2230 REM Highest difference peak 3.963, deepest hole -1.397, 1-sigma level 0.238 Q1 1 0.9425 0.4782 0.1833 11.00000 0.05 3.96 Q2 1 1.0347 0.5134 0.3806 11.00000 0.05 1.61 Q3 1 0.9668 0.4527 0.3400 11.00000 0.05 1.58 Q4 1 1.0622 0.5558 0.1957 11.00000 0.05 1.45 Q5 1 0.8509 0.4145 0.2621 11.00000 0.05 1.23 Q6 1 1.1541 0.5966 0.3034 11.00000 0.05 1.22 Q7 1 1.1522 0.6046 0.2029 11.00000 0.05 1.03 Q8 1 0.4209 0.2015 0.3023 11.00000 0.05 0.84 Q9 1 0.8049 0.5900 0.3824 11.00000 0.05 0.84 Q10 1 0.9520 0.3255 0.3876 11.00000 0.05 0.83 Q11 1 1.3130 0.3880 -0.1352 11.00000 0.05 0.78 Q12 1 1.1036 0.6526 0.1257 11.00000 0.05 0.77 Q13 1 1.0588 0.4043 0.3818 11.00000 0.05 0.76 Q14 1 1.1349 0.5575 0.1106 11.00000 0.05 0.74 Q15 1 0.4982 0.2921 0.2751 11.00000 0.05 0.73 Q16 1 1.0954 0.4763 0.4603 11.00000 0.05 0.72 Q17 1 1.2840 0.8235 0.1853 11.00000 0.05 0.71 Q18 1 0.8372 0.1558 0.2562 11.00000 0.05 0.71 Q19 1 0.9272 0.5860 0.3631 11.00000 0.05 0.69 Q20 1 1.3685 0.7523 0.3052 11.00000 0.05 0.68 ; _[local]_cod_data_source_file tk5067.cif _[local]_cod_data_source_block I _cod_database_code 2234426 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' 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 _atom_site_occupancy _atom_site_symmetry_multiplicity Pt Pt1 1.01671(5) 0.50573(3) 0.26893(3) 0.02699(12) Uani d . 1 1 S S1 1.3097(3) 0.6767(2) 0.2720(2) 0.0351(5) Uani d . 1 1 S S2 0.9284(4) 0.6445(2) 0.4314(2) 0.0367(5) Uani d . 1 1 N N1 1.0971(10) 0.3699(7) 0.1344(7) 0.0256(15) Uani d . 1 1 N N2 0.9426(11) 0.1761(8) 0.2524(7) 0.0307(16) Uani d . 1 1 H H2N 0.9464 0.0901 0.2805 0.046 Uiso d R 1 1 N N3 0.7667(10) 0.3445(7) 0.2845(7) 0.0254(15) Uani d . 1 1 N N4 1.2719(12) 0.8295(9) 0.0535(9) 0.043(2) Uani d . 1 1 N N5 0.9605(17) 0.9069(9) 0.3291(10) 0.060(3) Uani d . 1 1 C C1 1.2059(12) 0.4162(9) 0.0350(9) 0.0293(19) Uani d . 1 1 H H1 1.2247 0.5119 0.0157 0.035 Uiso calc R 1 1 C C2 1.2890(14) 0.3335(10) -0.0382(9) 0.036(2) Uani d . 1 1 H H2 1.3633 0.3698 -0.1081 0.044 Uiso calc R 1 1 C C3 1.2635(14) 0.1923(11) -0.0089(10) 0.041(2) Uani d . 1 1 H H3 1.3234 0.1322 -0.0570 0.050 Uiso calc R 1 1 C C4 1.1520(13) 0.1437(9) 0.0890(9) 0.034(2) Uani d . 1 1 H H4 1.1351 0.0490 0.1107 0.041 Uiso calc R 1 1 C C5 1.0619(12) 0.2315(9) 0.1582(9) 0.0272(18) Uani d . 1 1 C C6 0.7784(14) 0.2105(10) 0.2872(9) 0.034(2) Uani d . 1 1 C C7 0.6286(13) 0.1040(10) 0.3285(10) 0.038(2) Uani d . 1 1 H H7 0.6401 0.0104 0.3319 0.045 Uiso calc R 1 1 C C8 0.4652(15) 0.1353(12) 0.3638(10) 0.048(3) Uani d . 1 1 H H8 0.3619 0.0636 0.3925 0.058 Uiso calc R 1 1 C C9 0.4500(14) 0.2743(12) 0.3578(9) 0.042(2) Uani d . 1 1 H H9 0.3369 0.2980 0.3818 0.051 Uiso calc R 1 1 C C10 0.6011(12) 0.3736(11) 0.3166(9) 0.035(2) Uani d . 1 1 H H10 0.5906 0.4670 0.3101 0.042 Uiso calc R 1 1 C C11 1.2825(13) 0.7673(10) 0.1414(10) 0.035(2) Uani d . 1 1 C C12 0.9486(13) 0.7994(10) 0.3678(9) 0.033(2) Uani d . 1 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 Pt1 0.0312(2) 0.02336(19) 0.0312(2) 0.01455(14) 0.00534(13) 0.00443(13) S1 0.0337(12) 0.0298(12) 0.0411(13) 0.0094(10) -0.0007(10) -0.0008(10) S2 0.0573(15) 0.0285(12) 0.0319(12) 0.0220(11) 0.0132(11) 0.0064(9) N1 0.025(4) 0.017(3) 0.036(4) 0.007(3) 0.005(3) 0.003(3) N2 0.039(4) 0.023(4) 0.034(4) 0.014(3) 0.006(3) 0.006(3) N3 0.025(4) 0.021(3) 0.029(4) 0.003(3) 0.004(3) 0.009(3) N4 0.031(4) 0.033(5) 0.064(6) 0.006(4) 0.005(4) 0.014(4) N5 0.100(8) 0.028(5) 0.066(7) 0.033(5) 0.030(6) 0.018(4) C1 0.027(4) 0.025(4) 0.038(5) 0.012(4) 0.005(4) 0.002(4) C2 0.041(5) 0.037(5) 0.028(5) 0.007(4) 0.007(4) -0.002(4) C3 0.030(5) 0.046(6) 0.053(6) 0.020(5) 0.007(5) -0.002(5) C4 0.039(5) 0.021(4) 0.039(5) 0.007(4) -0.012(4) -0.007(4) C5 0.025(4) 0.021(4) 0.037(5) 0.010(3) -0.003(4) -0.003(3) C6 0.039(5) 0.039(5) 0.028(5) 0.015(4) 0.001(4) 0.003(4) C7 0.033(5) 0.028(5) 0.044(6) -0.008(4) 0.004(4) 0.010(4) C8 0.035(6) 0.056(7) 0.042(6) -0.007(5) 0.007(5) 0.010(5) C9 0.032(5) 0.068(7) 0.025(5) 0.018(5) -0.006(4) -0.011(5) C10 0.022(4) 0.047(6) 0.040(5) 0.014(4) 0.004(4) 0.005(4) C11 0.031(5) 0.024(5) 0.050(6) 0.008(4) 0.011(4) 0.006(4) C12 0.036(5) 0.027(5) 0.038(5) 0.012(4) 0.009(4) 0.003(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' N N 0.0061 0.0033 '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' S S 0.1246 0.1234 '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 _geom_angle_publ_flag N1 Pt1 N3 88.1(3) y N1 Pt1 S2 175.3(2) ? N3 Pt1 S2 89.9(2) ? N1 Pt1 S1 92.6(2) ? N3 Pt1 S1 173.6(2) ? S2 Pt1 S1 89.04(9) y C11 S1 Pt1 103.7(3) ? C12 S2 Pt1 104.4(3) ? C1 N1 C5 118.6(7) ? C1 N1 Pt1 122.7(5) ? C5 N1 Pt1 118.0(6) ? C5 N2 C6 127.6(7) ? C5 N2 H2N 118.5 ? C6 N2 H2N 111.5 ? C6 N3 C10 118.9(8) ? C6 N3 Pt1 118.7(6) ? C10 N3 Pt1 121.3(6) ? C2 C1 N1 123.3(8) ? C2 C1 H1 118.4 ? N1 C1 H1 118.4 ? C1 C2 C3 118.5(9) ? C1 C2 H2 120.7 ? C3 C2 H2 120.7 ? C4 C3 C2 118.8(9) ? C4 C3 H3 120.6 ? C2 C3 H3 120.6 ? C3 C4 C5 120.5(9) ? C3 C4 H4 119.7 ? C5 C4 H4 119.7 ? N1 C5 N2 121.2(7) ? N1 C5 C4 120.0(8) ? N2 C5 C4 118.7(8) ? N3 C6 N2 120.6(8) ? N3 C6 C7 121.3(9) ? N2 C6 C7 118.1(9) ? C8 C7 C6 119.3(10) ? C8 C7 H7 120.3 ? C6 C7 H7 120.3 ? C7 C8 C9 119.7(9) ? C7 C8 H8 120.2 ? C9 C8 H8 120.2 ? C10 C9 C8 118.2(9) ? C10 C9 H9 120.9 ? C8 C9 H9 120.9 ? N3 C10 C9 122.6(9) ? N3 C10 H10 118.7 ? C9 C10 H10 118.7 ? N4 C11 S1 177.4(9) ? N5 C12 S2 177.3(9) ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_publ_flag Pt1 N1 2.065(7) y Pt1 N3 2.069(7) y Pt1 S2 2.302(2) y Pt1 S1 2.306(2) y S1 C11 1.694(10) ? S2 C12 1.674(9) ? N1 C1 1.349(11) ? N1 C5 1.356(10) ? N2 C5 1.371(11) ? N2 C6 1.379(12) ? N2 H2N 0.9200 ? N3 C6 1.346(11) ? N3 C10 1.356(11) ? N4 C11 1.137(12) ? N5 C12 1.139(12) ? C1 C2 1.347(12) ? C1 H1 0.9500 ? C2 C3 1.406(14) ? C2 H2 0.9500 ? C3 C4 1.352(14) ? C3 H3 0.9500 ? C4 C5 1.394(12) ? C4 H4 0.9500 ? C6 C7 1.390(13) ? C7 C8 1.361(15) ? C7 H7 0.9500 ? C8 C9 1.407(16) ? C8 H8 0.9500 ? C9 C10 1.358(14) ? C9 H9 0.9500 ? C10 H10 0.9500 ? loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_site_symmetry_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA N2 H2N N5 1_545 0.92 1.93 2.851(11) 176.4 loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion N1 Pt1 S1 C11 84.1(4) S2 Pt1 S1 C11 -100.3(3) N3 Pt1 S2 C12 -129.1(4) S1 Pt1 S2 C12 57.3(4) N3 Pt1 N1 C1 149.1(7) S1 Pt1 N1 C1 -37.3(7) N3 Pt1 N1 C5 -40.4(6) S1 Pt1 N1 C5 133.2(6) N1 Pt1 N3 C6 40.9(7) S2 Pt1 N3 C6 -134.9(6) N1 Pt1 N3 C10 -151.7(7) S2 Pt1 N3 C10 32.5(7) C5 N1 C1 C2 -3.2(13) Pt1 N1 C1 C2 167.3(7) N1 C1 C2 C3 -0.8(14) C1 C2 C3 C4 1.9(14) C2 C3 C4 C5 0.9(14) C1 N1 C5 N2 -175.9(8) Pt1 N1 C5 N2 13.2(10) C1 N1 C5 C4 6.0(12) Pt1 N1 C5 C4 -164.9(6) C6 N2 C5 N1 35.0(13) C6 N2 C5 C4 -146.8(9) C3 C4 C5 N1 -4.9(13) C3 C4 C5 N2 176.8(8) C10 N3 C6 N2 178.5(8) Pt1 N3 C6 N2 -13.8(11) C10 N3 C6 C7 -3.3(13) Pt1 N3 C6 C7 164.4(7) C5 N2 C6 N3 -34.6(14) C5 N2 C6 C7 147.1(9) N3 C6 C7 C8 1.5(15) N2 C6 C7 C8 179.8(9) C6 C7 C8 C9 0.2(15) C7 C8 C9 C10 -0.2(15) C6 N3 C10 C9 3.4(13) Pt1 N3 C10 C9 -164.0(7) C8 C9 C10 N3 -1.6(14)