data_global _publ_contact_author_email uf@chemie.uni-paderborn.de _publ_contact_author_name 'Dr Ulrich Florke' _journal_name_full Org.Biomol.Chem. _journal_coden_Cambridge 0177 _publ_contact_author ; Dr Ulrich Florke Anorganische und Analytische Chemie Universit\"at Paderborn Warburgerstr. 100 D-33098 Paderborn, FRG ; _publ_contact_author_fax '+49 5251 60 3423' _publ_contact_author_phone '+49 5251 60 2496' _publ_contact_letter ; ; _publ_section_title ; Selective Synthesis of U-Shaped Terpyridines. Versatile Ligands for the Preparation of Platinum Complexes. ; _journal_volume ? _journal_page_first ? _journal_page_last ? _journal_year ? loop_ _publ_author_name _publ_author_address D.Sielemann ;Fakult\"at f\"ur Naturwissenschaften Department Chemie Universit\"at Paderborn Warburgerstr. 100 D-33098 Paderborn, FRG ; A.Winter ;Fakult\"at f\"ur Naturwissenschaften Department Chemie Universit\"at Paderborn Warburgerstr. 100 D-33098 Paderborn, FRG ; N.Risch ;Fakult\"at f\"ur Naturwissenschaften Department Chemie Universit\"at Paderborn Warburgerstr. 100 D-33098 Paderborn, FRG ; U.Florke ;Fakult\"at f\"ur Naturwissenschaften Department Chemie Universit\"at Paderborn Warburgerstr. 100 D-33098 Paderborn, FRG ; data_14e _database_code_depnum_ccdc_archive 'CCDC 152310' _chemical_name_common 'C36 H34 B2 F8 N6 O1 Pt1' _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_melting_point ? _chemical_formula_moiety '(C32 H28 N4 O Pt)(B F4)2 * 2 CH3CN' _chemical_formula_sum 'C36 H34 B2 F8 N6 O Pt' _chemical_formula_weight 935.40 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' 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' B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _symmetry_cell_setting Monoclinic _symmetry_space_group_name_H-M P2(1)/n loop_ _symmetry_equiv_pos_as_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' _cell_length_a 19.275(4) _cell_length_b 8.415(3) _cell_length_c 23.953(5) _cell_angle_alpha 90.00 _cell_angle_beta 111.90(1) _cell_angle_gamma 90.00 _cell_volume 3604.8(17) _cell_formula_units_Z 4 _cell_measurement_temperature 193(2) _cell_measurement_reflns_used 28 _cell_measurement_theta_min 6.143 _cell_measurement_theta_max 15.658 _exptl_crystal_description needle _exptl_crystal_colour yellow _exptl_crystal_size_max 0.60 _exptl_crystal_size_mid 0.12 _exptl_crystal_size_min 0.08 _exptl_crystal_density_meas 'not measured' _exptl_crystal_density_method none _exptl_crystal_density_diffrn 1.724 _exptl_crystal_F_000 1840 _exptl_absorpt_coefficient_mu 3.974 _exptl_absorpt_correction_type gaussian _exptl_absorpt_correction_T_min 0.372 _exptl_absorpt_correction_T_max 0.750 _exptl_absorpt_process_details ? _exptl_special_details ; ? ; _diffrn_ambient_temperature 193(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 'Bruker P4' _diffrn_measurement_method '\w scans' _diffrn_standards_number 3 _diffrn_standards_interval_count 397 _diffrn_standards_decay_% 6 _diffrn_reflns_number 7818 _diffrn_reflns_av_R_equivalents 0.0654 _diffrn_reflns_av_sigmaI/netI 0.0835 _diffrn_reflns_limit_h_min -1 _diffrn_reflns_limit_h_max 22 _diffrn_reflns_limit_k_min -10 _diffrn_reflns_limit_k_max 1 _diffrn_reflns_limit_l_min -28 _diffrn_reflns_limit_l_max 26 _diffrn_reflns_theta_min 2.55 _diffrn_reflns_theta_max 25.00 _reflns_number_total 6263 _reflns_number_gt 4428 _reflns_threshold_expression >2sigma(I) _computing_data_collection 'Bruker XSCANS' _computing_cell_refinement 'Bruker XSCANS' _computing_data_reduction 'Bruker SHELXTL' _computing_structure_solution 'Bruker SHELXTL' _computing_structure_refinement 'Bruker SHELXTL' _computing_molecular_graphics 'Bruker SHELXTL' _computing_publication_material 'Bruker SHELXTL' _refine_special_details ; Refinement of F^2^ against ALL reflections. The weighted R-factor wR and goodness 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 threshold expression of F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) 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 _refine_ls_weighting_details 'calc w=1/[\s^2^(Fo^2^)+(0.0732P)^2^] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens 'geom and difmap' _refine_ls_hydrogen_treatment constr _refine_ls_extinction_method none _refine_ls_extinction_coef ? _refine_ls_number_reflns 6263 _refine_ls_number_parameters 489 _refine_ls_number_restraints 835 _refine_ls_R_factor_all 0.0902 _refine_ls_R_factor_gt 0.0537 _refine_ls_wR_factor_ref 0.1367 _refine_ls_wR_factor_gt 0.1207 _refine_ls_goodness_of_fit_ref 1.025 _refine_ls_restrained_S_all 0.965 _refine_ls_shift/su_max 0.131 _refine_ls_shift/su_mean 0.002 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 Pt1 Pt -0.400196(18) 2.69449(4) -0.371917(14) 0.02926(13) Uani 1 1 d U . . N1 N -0.4559(4) 2.4866(9) -0.4031(3) 0.0350(16) Uani 1 1 d U . . N2 N -0.4894(4) 2.7298(9) -0.3554(3) 0.0302(15) Uani 1 1 d U . . N3 N -0.3766(4) 2.9155(9) -0.3337(3) 0.0326(15) Uani 1 1 d U . . N4 N -0.3062(4) 2.6524(9) -0.3882(3) 0.0336(17) Uani 1 1 d U . . O1 O -0.8877(3) 2.8350(9) -0.2953(3) 0.0489(19) Uani 1 1 d U . . C1 C -0.4385(5) 2.3617(12) -0.4296(4) 0.041(2) Uani 1 1 d U . . H1 H -0.3928 2.3628 -0.4361 0.049 Uiso 1 1 calc R . . C2 C -0.4850(6) 2.2307(13) -0.4480(5) 0.051(3) Uani 1 1 d U . . H2 H -0.4701 2.1425 -0.4657 0.062 Uiso 1 1 calc R . . C3 C -0.5529(6) 2.2274(12) -0.4408(5) 0.047(2) Uani 1 1 d U . . H3 H -0.5847 2.1375 -0.4536 0.057 Uiso 1 1 calc R . . C4 C -0.5743(5) 2.3560(12) -0.4148(4) 0.037(2) Uani 1 1 d U . . C5 C -0.5242(5) 2.4822(11) -0.3959(4) 0.0315(17) Uani 1 1 d U . . C6 C -0.6498(5) 2.3794(14) -0.4115(5) 0.052(3) Uani 1 1 d U . . H6A H -0.6841 2.4201 -0.4509 0.063 Uiso 1 1 calc R . . H6B H -0.6689 2.2742 -0.4054 0.063 Uiso 1 1 calc R . . C7 C -0.6535(5) 2.4894(13) -0.3635(4) 0.047(2) Uani 1 1 d U . . H7A H -0.6394 2.4292 -0.3254 0.057 Uiso 1 1 calc R . . H7B H -0.7059 2.5248 -0.3746 0.057 Uiso 1 1 calc R . . C8 C -0.6035(5) 2.6363(12) -0.3525(4) 0.0337(19) Uani 1 1 d U . . C9 C -0.5406(5) 2.6223(12) -0.3671(4) 0.0355(19) Uani 1 1 d U . . C10 C -0.6130(5) 2.7764(11) -0.3270(4) 0.0326(18) Uani 1 1 d U . . C11 C -0.4953(4) 2.8650(11) -0.3279(4) 0.0304(17) Uani 1 1 d U . . C12 C -0.5579(4) 2.8984(12) -0.3138(4) 0.0341(19) Uani 1 1 d U . . C13 C -0.5594(5) 3.0544(13) -0.2872(4) 0.048(2) Uani 1 1 d U . . H13A H -0.5809 3.0408 -0.2558 0.057 Uiso 1 1 calc R . . H13B H -0.5940 3.1233 -0.3189 0.057 Uiso 1 1 calc R . . C14 C -0.4875(6) 3.1393(14) -0.2598(6) 0.062(3) Uani 1 1 d U . . H14A H -0.4681 3.1181 -0.2160 0.074 Uiso 1 1 calc R . . H14B H -0.4980 3.2546 -0.2652 0.074 Uiso 1 1 calc R . . C15 C -0.4264(5) 3.1032(12) -0.2819(4) 0.036(2) Uani 1 1 d U . . C16 C -0.4304(4) 2.9700(11) -0.3146(3) 0.0293(17) Uani 1 1 d U . . C17 C -0.3621(5) 3.1985(13) -0.2687(4) 0.046(2) Uani 1 1 d U . . H17 H -0.3572 3.2949 -0.2470 0.056 Uiso 1 1 calc R . . C18 C -0.3069(5) 3.1495(12) -0.2879(4) 0.039(2) Uani 1 1 d U . . H18 H -0.2631 3.2121 -0.2793 0.047 Uiso 1 1 calc R . . C19 C -0.3148(5) 3.0090(11) -0.3196(4) 0.0345(19) Uani 1 1 d U . . H19 H -0.2756 2.9765 -0.3321 0.041 Uiso 1 1 calc R . . C20 C -0.6830(4) 2.8063(12) -0.3152(4) 0.0337(19) Uani 1 1 d U . . C21 C -0.7379(5) 2.9023(13) -0.3535(4) 0.040(2) Uani 1 1 d U . . H21 H -0.7285 2.9604 -0.3839 0.047 Uiso 1 1 calc R . . C22 C -0.8078(5) 2.9156(13) -0.3482(4) 0.042(2) Uani 1 1 d U . . H22 H -0.8458 2.9802 -0.3755 0.051 Uiso 1 1 calc R . . C23 C -0.8210(5) 2.8335(12) -0.3026(4) 0.036(2) Uani 1 1 d U . . C24 C -0.7648(5) 2.7422(15) -0.2637(5) 0.055(3) Uani 1 1 d U . . H24 H -0.7732 2.6881 -0.2319 0.066 Uiso 1 1 calc R . . C25 C -0.6970(5) 2.7269(15) -0.2693(5) 0.053(3) Uani 1 1 d U . . H25 H -0.6593 2.6620 -0.2419 0.064 Uiso 1 1 calc R . . C26 C -0.9498(5) 2.9086(15) -0.3415(5) 0.056(3) Uani 1 1 d U . . H26A H -0.9943 2.9009 -0.3311 0.085 Uiso 1 1 calc R . . H26B H -0.9592 2.8546 -0.3799 0.085 Uiso 1 1 calc R . . H26C H -0.9383 3.0207 -0.3451 0.085 Uiso 1 1 calc R . . C27 C -0.2653(5) 2.5207(12) -0.3676(4) 0.041(2) Uani 1 1 d U . . H27 H -0.2807 2.4502 -0.3435 0.050 Uiso 1 1 calc R . . C28 C -0.2030(5) 2.4810(13) -0.3789(4) 0.048(2) Uani 1 1 d U . . H28 H -0.1758 2.3870 -0.3624 0.058 Uiso 1 1 calc R . . C29 C -0.1800(5) 2.5822(14) -0.4155(4) 0.044(2) Uani 1 1 d U . . C30 C -0.2207(5) 2.7178(13) -0.4364(4) 0.042(2) Uani 1 1 d U . . H30 H -0.2064 2.7895 -0.4608 0.050 Uiso 1 1 calc R . . C31 C -0.2829(5) 2.7518(12) -0.4221(4) 0.035(2) Uani 1 1 d U . . H31 H -0.3097 2.8475 -0.4366 0.042 Uiso 1 1 calc R . . C32 C -0.1134(6) 2.5385(18) -0.4311(6) 0.083(4) Uani 1 1 d U . . H32A H -0.0927 2.4371 -0.4120 0.125 Uiso 1 1 calc R . . H32B H -0.0752 2.6215 -0.4166 0.125 Uiso 1 1 calc R . . H32C H -0.1291 2.5284 -0.4749 0.125 Uiso 1 1 calc R . . B1 B 0.1762(5) 1.3469(11) 0.0000(4) 0.050(3) Uani 1 1 d DU . . F11 F 0.2087(5) 1.2131(8) -0.0089(3) 0.117(3) Uani 1 1 d DU . . F12 F 0.1886(4) 1.3661(8) 0.0598(2) 0.0681(19) Uani 1 1 d DU . . F13 F 0.0999(3) 1.3403(9) -0.0319(3) 0.080(2) Uani 1 1 d DU . . F14 F 0.2028(3) 1.4763(8) -0.0205(3) 0.0683(18) Uani 1 1 d DU . . B2 B -0.4028(5) 2.6008(11) -0.1996(4) 0.042(2) Uani 1 1 d DU . . F21 F -0.3598(4) 2.4886(9) -0.1606(3) 0.089(2) Uani 1 1 d DU . . F22 F -0.4360(4) 2.6985(8) -0.1706(3) 0.079(2) Uani 1 1 d DU . . F23 F -0.4571(3) 2.5256(7) -0.2470(2) 0.0630(17) Uani 1 1 d DU . . F24 F -0.3593(3) 2.6949(8) -0.2212(3) 0.0701(19) Uani 1 1 d DU . . N100 N -0.9791(7) 2.7656(17) -0.4953(6) 0.100(4) Uani 1 1 d U . . C101 C -0.9382(7) 2.8388(17) -0.5082(5) 0.067(4) Uani 1 1 d U . . C102 C -0.8861(6) 2.9359(17) -0.5228(5) 0.074(4) Uani 1 1 d U . . H10A H -0.8889 2.9102 -0.5635 0.111 Uiso 1 1 calc R . . H10B H -0.8354 2.9155 -0.4939 0.111 Uiso 1 1 calc R . . H10C H -0.8986 3.0482 -0.5210 0.111 Uiso 1 1 calc R . . N200 N -0.8195(7) 3.2737(15) -0.4156(6) 0.085(4) Uani 1 1 d U . . C201 C -0.8568(7) 3.3533(17) -0.4014(6) 0.070(4) Uani 1 1 d U . . C202 C -0.9057(8) 3.451(2) -0.3828(7) 0.113(6) Uani 1 1 d U . . H20A H -0.9411 3.5060 -0.4178 0.169 Uiso 1 1 calc R . . H20B H -0.8760 3.5287 -0.3532 0.169 Uiso 1 1 calc R . . H20C H -0.9332 3.3834 -0.3647 0.169 Uiso 1 1 calc R . . 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 Pt1 0.02717(18) 0.0335(2) 0.03289(18) -0.00006(19) 0.01789(13) 0.0019(2) N1 0.038(4) 0.037(4) 0.038(4) -0.001(3) 0.024(3) -0.004(3) N2 0.027(3) 0.031(4) 0.037(4) 0.015(3) 0.016(3) 0.009(3) N3 0.032(3) 0.037(4) 0.037(4) -0.004(3) 0.022(3) -0.001(3) N4 0.034(4) 0.036(4) 0.034(4) 0.018(3) 0.017(3) 0.011(3) O1 0.036(3) 0.067(5) 0.057(4) 0.019(4) 0.033(3) 0.013(3) C1 0.043(5) 0.041(5) 0.046(5) -0.003(4) 0.024(4) 0.007(4) C2 0.054(6) 0.044(6) 0.067(6) -0.012(5) 0.036(5) 0.001(5) C3 0.044(5) 0.037(6) 0.065(6) -0.011(5) 0.025(5) -0.004(4) C4 0.034(4) 0.038(5) 0.040(5) -0.006(4) 0.015(4) -0.004(4) C5 0.032(4) 0.033(4) 0.032(4) 0.003(4) 0.015(3) 0.003(3) C6 0.042(5) 0.055(6) 0.071(6) -0.020(5) 0.034(5) -0.011(5) C7 0.042(5) 0.047(6) 0.064(6) -0.006(5) 0.033(5) -0.007(5) C8 0.026(4) 0.043(5) 0.036(4) 0.000(4) 0.015(4) -0.002(4) C9 0.028(4) 0.045(5) 0.037(4) -0.004(4) 0.016(4) -0.007(4) C10 0.031(4) 0.040(5) 0.031(4) 0.012(4) 0.017(3) 0.010(4) C11 0.025(4) 0.037(4) 0.030(4) 0.007(4) 0.011(3) 0.002(3) C12 0.027(4) 0.046(5) 0.038(4) -0.001(4) 0.021(4) 0.000(4) C13 0.050(5) 0.050(6) 0.057(6) -0.016(5) 0.034(5) -0.006(5) C14 0.061(6) 0.054(7) 0.091(8) -0.032(6) 0.051(6) -0.011(5) C15 0.037(4) 0.040(5) 0.037(4) -0.007(4) 0.020(4) -0.002(4) C16 0.027(4) 0.036(4) 0.029(4) 0.008(3) 0.017(3) 0.008(3) C17 0.049(5) 0.041(5) 0.056(5) -0.009(5) 0.028(5) -0.003(5) C18 0.033(4) 0.041(5) 0.045(5) -0.002(4) 0.015(4) -0.007(4) C19 0.036(4) 0.038(5) 0.034(4) -0.003(4) 0.018(4) -0.006(4) C20 0.024(4) 0.044(5) 0.038(4) 0.009(4) 0.017(3) 0.002(4) C21 0.035(4) 0.055(6) 0.037(4) 0.006(4) 0.023(4) 0.006(4) C22 0.035(4) 0.061(7) 0.039(5) 0.015(5) 0.023(4) 0.014(5) C23 0.028(4) 0.049(6) 0.040(4) 0.005(4) 0.023(3) 0.008(4) C24 0.039(5) 0.083(8) 0.055(6) 0.036(5) 0.031(5) 0.020(5) C25 0.035(5) 0.079(8) 0.056(6) 0.028(5) 0.027(4) 0.019(5) C26 0.031(5) 0.082(9) 0.067(6) 0.010(6) 0.030(4) 0.015(6) C27 0.046(5) 0.038(5) 0.048(5) 0.008(4) 0.026(4) 0.010(4) C28 0.043(5) 0.049(6) 0.059(6) 0.009(5) 0.027(5) 0.011(5) C29 0.037(5) 0.052(6) 0.052(5) 0.004(5) 0.026(4) 0.015(5) C30 0.041(5) 0.051(6) 0.043(5) 0.003(5) 0.028(4) 0.001(5) C31 0.035(5) 0.037(5) 0.041(5) 0.008(4) 0.022(4) 0.009(4) C32 0.063(7) 0.092(11) 0.123(10) 0.010(9) 0.066(7) 0.017(7) B1 0.063(6) 0.041(6) 0.042(5) -0.001(5) 0.016(5) -0.005(6) F11 0.173(8) 0.058(5) 0.091(5) -0.016(4) 0.015(5) 0.048(6) F12 0.100(5) 0.059(4) 0.047(3) -0.002(3) 0.030(3) -0.024(4) F13 0.067(4) 0.115(7) 0.059(4) -0.012(4) 0.024(3) -0.029(4) F14 0.082(4) 0.073(4) 0.071(4) 0.009(4) 0.052(3) -0.002(4) B2 0.039(6) 0.050(7) 0.038(5) 0.001(5) 0.015(4) -0.001(5) F21 0.082(5) 0.102(6) 0.062(4) 0.029(4) 0.002(3) 0.021(4) F22 0.083(5) 0.073(5) 0.106(5) -0.031(4) 0.065(4) -0.018(4) F23 0.074(4) 0.053(4) 0.048(3) 0.003(3) 0.006(3) -0.018(3) F24 0.059(4) 0.101(6) 0.059(4) 0.002(4) 0.032(3) -0.025(4) N100 0.090(9) 0.104(11) 0.125(10) -0.025(9) 0.064(8) -0.029(8) C101 0.056(7) 0.092(11) 0.057(6) -0.026(7) 0.026(5) -0.015(6) C102 0.072(8) 0.088(10) 0.072(7) -0.006(8) 0.038(6) -0.008(7) N200 0.076(8) 0.076(9) 0.119(9) 0.001(7) 0.054(7) -0.012(6) C201 0.059(8) 0.067(9) 0.077(8) 0.005(7) 0.017(6) -0.003(6) C202 0.104(11) 0.111(14) 0.101(11) -0.042(10) 0.013(9) 0.020(10) _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 Pt1 N2 1.926(7) . ? Pt1 N4 2.021(7) . ? Pt1 N1 2.043(8) . ? Pt1 N3 2.048(8) . ? N1 C1 1.335(11) . ? N1 C5 1.390(10) . ? N2 C9 1.290(11) . ? N2 C11 1.340(11) . ? N3 C16 1.359(10) . ? N3 C19 1.362(11) . ? N4 C27 1.343(11) . ? N4 C31 1.355(11) . ? O1 C23 1.362(9) . ? O1 C26 1.432(11) . ? C1 C2 1.385(14) . ? C2 C3 1.383(14) . ? C3 C4 1.385(13) . ? C4 C5 1.393(12) . ? C4 C6 1.500(12) . ? C5 C9 1.458(13) . ? C6 C7 1.498(13) . ? C7 C8 1.528(13) . ? C8 C10 1.372(13) . ? C8 C9 1.386(11) . ? C10 C12 1.425(13) . ? C10 C20 1.500(11) . ? C11 C12 1.398(11) . ? C11 C16 1.465(12) . ? C12 C13 1.464(13) . ? C13 C14 1.478(13) . ? C14 C15 1.491(12) . ? C15 C16 1.352(12) . ? C15 C17 1.408(13) . ? C17 C18 1.371(13) . ? C18 C19 1.384(13) . ? C20 C21 1.375(12) . ? C20 C25 1.394(12) . ? C21 C22 1.402(11) . ? C22 C23 1.393(12) . ? C23 C24 1.370(13) . ? C24 C25 1.370(13) . ? C27 C28 1.368(12) . ? C28 C29 1.407(14) . ? C29 C30 1.369(14) . ? C29 C32 1.510(13) . ? C30 C31 1.393(12) . ? B1 F11 1.344(10) . ? B1 F12 1.370(9) . ? B1 F14 1.370(9) . ? B1 F13 1.383(10) . ? B2 F21 1.369(9) . ? B2 F23 1.377(9) . ? B2 F22 1.379(9) . ? B2 F24 1.386(9) . ? N100 C101 1.131(16) . ? C101 C102 1.434(16) . ? N200 C201 1.124(16) . ? C201 C202 1.438(18) . ? 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 N2 Pt1 N4 178.6(3) . . ? N2 Pt1 N1 79.6(3) . . ? N4 Pt1 N1 99.6(3) . . ? N2 Pt1 N3 80.4(3) . . ? N4 Pt1 N3 100.4(3) . . ? N1 Pt1 N3 160.0(3) . . ? C1 N1 C5 117.2(8) . . ? C1 N1 Pt1 131.0(6) . . ? C5 N1 Pt1 111.7(6) . . ? C9 N2 C11 120.2(8) . . ? C9 N2 Pt1 121.1(6) . . ? C11 N2 Pt1 118.5(6) . . ? C16 N3 C19 115.4(8) . . ? C16 N3 Pt1 112.8(6) . . ? C19 N3 Pt1 131.5(6) . . ? C27 N4 C31 116.7(8) . . ? C27 N4 Pt1 121.3(6) . . ? C31 N4 Pt1 122.0(6) . . ? C23 O1 C26 117.5(7) . . ? N1 C1 C2 122.0(9) . . ? C1 C2 C3 120.4(9) . . ? C4 C3 C2 119.7(9) . . ? C3 C4 C5 117.1(8) . . ? C3 C4 C6 125.7(9) . . ? C5 C4 C6 116.8(8) . . ? N1 C5 C4 123.6(8) . . ? N1 C5 C9 114.8(8) . . ? C4 C5 C9 121.6(8) . . ? C7 C6 C4 116.5(8) . . ? C6 C7 C8 115.1(8) . . ? C10 C8 C9 117.4(8) . . ? C10 C8 C7 126.3(8) . . ? C9 C8 C7 116.2(8) . . ? N2 C9 C8 123.8(9) . . ? N2 C9 C5 112.7(8) . . ? C8 C9 C5 123.5(8) . . ? C8 C10 C12 120.4(8) . . ? C8 C10 C20 120.5(8) . . ? C12 C10 C20 119.1(8) . . ? N2 C11 C12 121.9(8) . . ? N2 C11 C16 113.4(7) . . ? C12 C11 C16 124.7(9) . . ? C11 C12 C10 116.1(8) . . ? C11 C12 C13 116.4(8) . . ? C10 C12 C13 127.5(8) . . ? C12 C13 C14 117.3(8) . . ? C13 C14 C15 118.6(9) . . ? C16 C15 C17 117.3(8) . . ? C16 C15 C14 119.4(8) . . ? C17 C15 C14 123.3(9) . . ? C15 C16 N3 126.0(8) . . ? C15 C16 C11 119.1(8) . . ? N3 C16 C11 114.8(8) . . ? C18 C17 C15 118.8(9) . . ? C17 C18 C19 120.1(9) . . ? N3 C19 C18 122.4(8) . . ? C21 C20 C25 118.7(8) . . ? C21 C20 C10 119.7(7) . . ? C25 C20 C10 121.3(8) . . ? C20 C21 C22 120.9(8) . . ? C23 C22 C21 119.5(8) . . ? O1 C23 C24 117.5(8) . . ? O1 C23 C22 123.6(8) . . ? C24 C23 C22 118.9(8) . . ? C25 C24 C23 121.7(9) . . ? C24 C25 C20 120.3(9) . . ? N4 C27 C28 124.5(9) . . ? C27 C28 C29 118.7(10) . . ? C30 C29 C28 117.5(8) . . ? C30 C29 C32 122.5(10) . . ? C28 C29 C32 120.0(10) . . ? C29 C30 C31 120.6(9) . . ? N4 C31 C30 122.0(9) . . ? F11 B1 F12 110.8(8) . . ? F11 B1 F14 110.5(8) . . ? F12 B1 F14 109.8(7) . . ? F11 B1 F13 110.0(8) . . ? F12 B1 F13 108.5(7) . . ? F14 B1 F13 107.3(7) . . ? F21 B2 F23 109.0(7) . . ? F21 B2 F22 110.2(7) . . ? F23 B2 F22 109.7(7) . . ? F21 B2 F24 110.6(7) . . ? F23 B2 F24 109.5(6) . . ? F22 B2 F24 107.9(7) . . ? N100 C101 C102 177.7(15) . . ? N200 C201 C202 178.1(17) . . ? _diffrn_measured_fraction_theta_max 0.989 _diffrn_reflns_theta_full 25.00 _diffrn_measured_fraction_theta_full 0.989 _refine_diff_density_max 0.937 _refine_diff_density_min -0.884 _refine_diff_density_rms 0.164 #===End of CIF