#------------------------------------------------------------------------------ #$Date: 2019-02-09 03:59:04 +0200 (Sat, 09 Feb 2019) $ #$Revision: 213572 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/05/81/7058161.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_7058161 loop_ _publ_author_name 'Inci, Duygu' 'Ayd\?in, Rahmiye' 'Vatan, \"Ozg\"ur' '\,SAH\.IN, Onur' '\,Cink\?il\?i\,c, Nil\"ufer' _publ_section_title ; Water soluble binary and ternary palladium(II) complexes containing amino acids and intercalating ligands: Synthesis, characterization, biomolecular interactions and cytotoxicities ; _journal_name_full 'New Journal of Chemistry' _journal_paper_doi 10.1039/C8NJ05934A _journal_year 2019 _chemical_formula_moiety ' C24 H16 N4 Pd, 2(N O3) ' _chemical_formula_sum 'C24 H16 N6 O6 Pd' _chemical_formula_weight 590.83 _chemical_name_systematic ; ? ; _space_group_crystal_system monoclinic _space_group_IT_number 15 _space_group_name_Hall '-C 2yc' _space_group_name_H-M_alt 'C 1 2/c 1' _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _atom_sites_solution_hydrogens geom _audit_creation_method SHELXL-2013 _audit_update_record ; 2017-12-13 deposited with the CCDC. 2019-02-06 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 103.038(6) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 15.031(3) _cell_length_b 20.228(3) _cell_length_c 7.1314(9) _cell_measurement_reflns_used 9093 _cell_measurement_temperature 296 _cell_measurement_theta_max 28.30 _cell_measurement_theta_min 2.93 _cell_volume 2112.4(6) _computing_cell_refinement 'SAINT(Bruker, 2013)' _computing_data_collection 'APEX2 (Bruker, 2013)' _computing_data_reduction 'Bruker SAINT' _computing_molecular_graphics 'ORTEP-3 for Windows (Farrugia, 1997)' _computing_publication_material 'WinGX (Farrugia, 1999)' _computing_structure_refinement 'SHELXL-2013 (Sheldrick, 2013)' _computing_structure_solution 'SHELXS97 (Sheldrick, 2008)' _diffrn_ambient_temperature 296 _diffrn_measured_fraction_theta_full 0.996 _diffrn_measured_fraction_theta_max 0.997 _diffrn_measurement_device_type 'Bruker APEX-II CCD' _diffrn_measurement_method '\f and \w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0330 _diffrn_reflns_av_unetI/netI 0.0138 _diffrn_reflns_Laue_measured_fraction_full 0.996 _diffrn_reflns_Laue_measured_fraction_max 0.997 _diffrn_reflns_limit_h_max 20 _diffrn_reflns_limit_h_min -20 _diffrn_reflns_limit_k_max 26 _diffrn_reflns_limit_k_min -26 _diffrn_reflns_limit_l_max 9 _diffrn_reflns_limit_l_min -9 _diffrn_reflns_number 49525 _diffrn_reflns_point_group_measured_fraction_full 0.996 _diffrn_reflns_point_group_measured_fraction_max 0.997 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 28.325 _diffrn_reflns_theta_min 3.326 _diffrn_standards_number 0 _exptl_absorpt_coefficient_mu 0.939 _exptl_absorpt_correction_T_max 0.7457 _exptl_absorpt_correction_T_min 0.6374 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details Bruker _exptl_crystal_colour yellow _exptl_crystal_density_diffrn 1.858 _exptl_crystal_description block _exptl_crystal_F_000 1184 _exptl_crystal_size_max 0.19 _exptl_crystal_size_mid 0.15 _exptl_crystal_size_min 0.14 _refine_diff_density_max 0.835 _refine_diff_density_min -0.827 _refine_diff_density_rms 0.101 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.135 _refine_ls_hydrogen_treatment constr _refine_ls_matrix_type full _refine_ls_number_parameters 174 _refine_ls_number_reflns 2627 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.135 _refine_ls_R_factor_all 0.0375 _refine_ls_R_factor_gt 0.0346 _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^)+(0.0301P)^2^+8.0843P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0821 _refine_ls_wR_factor_ref 0.0849 _reflns_Friedel_coverage 0.000 _reflns_number_gt 2456 _reflns_number_total 2627 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file c8nj05934a2.cif _cod_data_source_block shelx _cod_original_cell_volume 2112.3(5) _cod_database_code 7058161 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelxl_version_number 2013-4 _shelx_res_file ; TITL 0_a.res in C2/c CELL 0.71073 15.0306 20.2282 7.1314 90.000 103.038 90.000 ZERR 4.00 0.0026 0.0026 0.0009 0.000 0.006 0.000 LATT 7 SYMM - X, Y, 1/2 - Z SFAC C H N O PD UNIT 96 64 24 24 4 MERG 2 OMIT -4.00 180.00 EQIV $1 -x+1, -y, -z+1 HTAB C1 O2_$1 HTAB C2 O2_$1 EQIV $2 x, -y+1, z+1/2 HTAB C9 O3_$2 FMAP 2 PLAN 5 ACTA BOND BOND $H CONF L.S. 10 WGHT 0.030100 8.084300 FVAR 0.39625 C1 1 0.389535 0.093618 0.151649 11.00000 0.05723 0.02919 = 0.04120 -0.00288 0.00458 -0.00883 AFIX 43 H1 2 0.442816 0.073189 0.136001 11.00000 -1.20000 AFIX 0 C2 1 0.307861 0.057237 0.117695 11.00000 0.07578 0.03176 = 0.05239 -0.00436 0.00452 -0.02545 AFIX 43 H2 2 0.308115 0.013049 0.081806 11.00000 -1.20000 AFIX 0 C3 1 0.228464 0.085748 0.136587 11.00000 0.05918 0.04818 = 0.04325 -0.00093 0.00304 -0.03148 AFIX 43 H3 2 0.175039 0.061016 0.118339 11.00000 -1.20000 AFIX 0 C4 1 0.228328 0.153310 0.184214 11.00000 0.04084 0.04540 = 0.02700 0.00430 0.00003 -0.02098 C5 1 0.148810 0.189232 0.201469 11.00000 0.03054 0.06735 = 0.03477 0.00562 0.00188 -0.02129 AFIX 43 H5 2 0.092977 0.167441 0.181483 11.00000 -1.20000 AFIX 0 C6 1 0.152968 0.254021 0.246087 11.00000 0.02573 0.06288 = 0.03806 0.00934 0.00508 -0.00727 AFIX 43 H6 2 0.100092 0.276160 0.256657 11.00000 -1.20000 AFIX 0 C7 1 0.237631 0.289314 0.277490 11.00000 0.02372 0.04762 = 0.02653 0.00855 0.00370 -0.00205 C8 1 0.247751 0.356168 0.332866 11.00000 0.03061 0.04305 = 0.03556 0.00654 0.00834 0.00847 AFIX 43 H8 2 0.197234 0.380850 0.345530 11.00000 -1.20000 AFIX 0 C9 1 0.332276 0.384459 0.367809 11.00000 0.03572 0.02916 = 0.04181 0.00098 0.01267 0.00573 AFIX 43 H9 2 0.340181 0.427940 0.410706 11.00000 -1.20000 AFIX 0 C10 1 0.407066 0.347859 0.338916 11.00000 0.02570 0.02689 = 0.03453 0.00067 0.00660 -0.00260 AFIX 43 H10 2 0.464102 0.368032 0.362006 11.00000 -1.20000 AFIX 0 C11 1 0.316245 0.255442 0.256895 11.00000 0.02372 0.03067 = 0.02354 0.00356 0.00214 -0.00541 C12 1 0.312149 0.186678 0.215335 11.00000 0.03257 0.03265 = 0.02252 0.00323 0.00140 -0.01158 N1 3 0.392307 0.156664 0.205705 11.00000 0.03811 0.02501 = 0.03147 0.00062 0.00379 -0.00800 N2 3 0.399710 0.285352 0.279723 11.00000 0.02252 0.02367 = 0.02821 0.00067 0.00577 -0.00218 N3 3 0.500000 0.088853 0.750000 10.50000 0.03582 0.05282 = 0.06800 0.00000 0.01040 0.00000 N4 3 0.500000 0.516342 0.250000 10.50000 0.03051 0.03183 = 0.03696 0.00000 0.00618 0.00000 O1 4 0.526578 0.125295 0.875507 10.75000 0.18606 0.24935 = 0.10580 -0.08734 0.07892 -0.15114 O2 4 0.554342 0.053236 0.825084 10.75000 0.08665 0.15660 = 0.39012 0.14547 0.00260 0.03136 O3 4 0.432790 0.485599 0.158820 11.00000 0.05504 0.05958 = 0.06185 0.00601 -0.00695 -0.03029 O4 4 0.500000 0.577521 0.250000 10.50000 0.05710 0.02625 = 0.08167 0.00000 0.01441 0.00000 PD1 5 0.500000 0.220789 0.250000 10.50000 0.02652 0.02096 = 0.03112 0.00000 0.00385 0.00000 HKLF 4 REM 0_a.res in C2/c REM R1 = 0.0346 for 2456 Fo > 4sig(Fo) and 0.0375 for all 2627 data REM 174 parameters refined using 0 restraints END WGHT 0.0301 8.0843 REM Highest difference peak 0.835, deepest hole -0.827, 1-sigma level 0.101 Q1 1 0.5571 0.0863 0.8928 11.00000 0.05 0.83 Q2 1 0.5000 0.1395 0.7500 10.50000 0.05 0.83 Q3 1 0.5000 0.3373 0.2500 10.50000 0.05 0.82 Q4 1 0.5178 0.1386 0.9071 11.00000 0.05 0.45 Q5 1 0.3592 0.3681 0.2881 11.00000 0.05 0.39 ; _shelx_res_checksum 8742 loop_ _space_group_symop_operation_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' 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_site_symmetry_order _atom_site_calc_flag _atom_site_refinement_flags_posn _atom_site_refinement_flags_adp _atom_site_refinement_flags_occupancy C1 C 0.3895(3) 0.09362(15) 0.1516(5) 0.0436(7) Uani 1 1 d . . . H1 H 0.4428 0.0732 0.1360 0.052 Uiso 1 1 calc R U . C2 C 0.3079(3) 0.05724(17) 0.1177(5) 0.0549(9) Uani 1 1 d . . . H2 H 0.3081 0.0130 0.0818 0.066 Uiso 1 1 calc R U . C3 C 0.2285(3) 0.08575(18) 0.1366(5) 0.0516(9) Uani 1 1 d . . . H3 H 0.1750 0.0610 0.1183 0.062 Uiso 1 1 calc R U . C4 C 0.2283(2) 0.15331(16) 0.1842(4) 0.0390(7) Uani 1 1 d . . . C5 C 0.1488(2) 0.18923(19) 0.2015(4) 0.0451(8) Uani 1 1 d . . . H5 H 0.0930 0.1674 0.1815 0.054 Uiso 1 1 calc R U . C6 C 0.1530(2) 0.25402(19) 0.2461(4) 0.0426(7) Uani 1 1 d . . . H6 H 0.1001 0.2762 0.2567 0.051 Uiso 1 1 calc R U . C7 C 0.23763(18) 0.28931(15) 0.2775(4) 0.0329(6) Uani 1 1 d . . . C8 C 0.24775(19) 0.35617(15) 0.3329(4) 0.0363(6) Uani 1 1 d . . . H8 H 0.1972 0.3809 0.3455 0.044 Uiso 1 1 calc R U . C9 C 0.3323(2) 0.38446(14) 0.3678(4) 0.0349(6) Uani 1 1 d . . . H9 H 0.3402 0.4279 0.4107 0.042 Uiso 1 1 calc R U . C10 C 0.40707(17) 0.34786(13) 0.3389(4) 0.0291(5) Uani 1 1 d . . . H10 H 0.4641 0.3680 0.3620 0.035 Uiso 1 1 calc R U . C11 C 0.31624(16) 0.25544(13) 0.2569(3) 0.0265(5) Uani 1 1 d . . . C12 C 0.31215(18) 0.18668(13) 0.2153(4) 0.0300(5) Uani 1 1 d . . . N1 N 0.39231(16) 0.15666(11) 0.2057(3) 0.0322(5) Uani 1 1 d . . . N2 N 0.39971(14) 0.28535(10) 0.2797(3) 0.0248(4) Uani 1 1 d . . . N3 N 0.5000 0.0889(2) 0.7500 0.0524(10) Uani 1 2 d S T P N4 N 0.5000 0.51634(17) 0.2500 0.0333(7) Uani 1 2 d S T P O1 O 0.5266(6) 0.1253(5) 0.8755(10) 0.173(4) Uani 0.75 1 d . . P O2 O 0.5543(5) 0.0532(5) 0.825(2) 0.219(6) Uani 0.75 1 d . . P O3 O 0.43279(19) 0.48560(14) 0.1588(4) 0.0620(8) Uani 1 1 d . . . O4 O 0.5000 0.57752(16) 0.2500 0.0552(9) Uani 1 2 d S T P Pd1 Pd 0.5000 0.22079(2) 0.2500 0.02662(10) Uani 1 2 d S T P 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 C1 0.0572(19) 0.0292(14) 0.0412(16) -0.0029(12) 0.0046(14) -0.0088(13) C2 0.076(3) 0.0318(16) 0.052(2) -0.0044(14) 0.0045(18) -0.0255(17) C3 0.059(2) 0.0482(19) 0.0432(17) -0.0009(14) 0.0030(15) -0.0315(17) C4 0.0408(15) 0.0454(16) 0.0270(13) 0.0043(11) 0.0000(11) -0.0210(13) C5 0.0305(14) 0.067(2) 0.0348(15) 0.0056(14) 0.0019(11) -0.0213(14) C6 0.0257(13) 0.063(2) 0.0381(15) 0.0093(14) 0.0051(11) -0.0073(13) C7 0.0237(12) 0.0476(16) 0.0265(12) 0.0085(11) 0.0037(9) -0.0020(11) C8 0.0306(13) 0.0431(15) 0.0356(14) 0.0065(12) 0.0083(11) 0.0085(11) C9 0.0357(14) 0.0292(13) 0.0418(15) 0.0010(11) 0.0127(12) 0.0057(11) C10 0.0257(11) 0.0269(12) 0.0345(13) 0.0007(10) 0.0066(10) -0.0026(9) C11 0.0237(11) 0.0307(12) 0.0235(11) 0.0036(9) 0.0021(9) -0.0054(9) C12 0.0326(13) 0.0327(13) 0.0225(11) 0.0032(10) 0.0014(9) -0.0116(10) N1 0.0381(12) 0.0250(10) 0.0315(11) 0.0006(9) 0.0038(9) -0.0080(9) N2 0.0225(10) 0.0237(10) 0.0282(10) 0.0007(8) 0.0058(8) -0.0022(7) N3 0.036(2) 0.053(2) 0.068(3) 0.000 0.0104(19) 0.000 N4 0.0305(16) 0.0318(16) 0.0370(17) 0.000 0.0062(13) 0.000 O1 0.186(8) 0.249(10) 0.106(5) -0.087(6) 0.079(5) -0.151(8) O2 0.087(5) 0.157(7) 0.390(16) 0.145(9) 0.003(7) 0.031(5) O3 0.0550(15) 0.0596(16) 0.0618(16) 0.0060(13) -0.0069(12) -0.0303(13) O4 0.057(2) 0.0263(15) 0.082(3) 0.000 0.0144(19) 0.000 Pd1 0.02652(15) 0.02096(14) 0.03112(16) 0.000 0.00385(10) 0.000 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' Pd Pd -0.9988 1.0072 '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_site_symmetry_1 _geom_angle_site_symmetry_3 N1 C1 C2 121.4(3) . . N1 C1 H1 119.3 . . C2 C1 H1 119.3 . . C3 C2 C1 120.9(3) . . C3 C2 H2 119.6 . . C1 C2 H2 119.6 . . C2 C3 C4 119.0(3) . . C2 C3 H3 120.5 . . C4 C3 H3 120.5 . . C12 C4 C3 117.1(3) . . C12 C4 C5 118.8(3) . . C3 C4 C5 124.2(3) . . C6 C5 C4 121.4(3) . . C6 C5 H5 119.3 . . C4 C5 H5 119.3 . . C5 C6 C7 121.0(3) . . C5 C6 H6 119.5 . . C7 C6 H6 119.5 . . C11 C7 C8 117.3(2) . . C11 C7 C6 118.7(3) . . C8 C7 C6 124.0(3) . . C9 C8 C7 119.4(3) . . C9 C8 H8 120.3 . . C7 C8 H8 120.3 . . C8 C9 C10 119.8(3) . . C8 C9 H9 120.1 . . C10 C9 H9 120.1 . . N2 C10 C9 122.5(2) . . N2 C10 H10 118.7 . . C9 C10 H10 118.7 . . N2 C11 C7 122.9(2) . . N2 C11 C12 116.9(2) . . C7 C11 C12 120.2(2) . . N1 C12 C4 123.4(3) . . N1 C12 C11 116.7(2) . . C4 C12 C11 120.0(3) . . C1 N1 C12 118.1(3) . . C1 N1 Pd1 128.7(2) . . C12 N1 Pd1 112.80(17) . . C10 N2 C11 117.8(2) . . C10 N2 Pd1 129.11(17) . . C11 N2 Pd1 112.54(17) . . O2 N3 O2 100.7(13) 2_656 . O2 N3 O1 149.1(7) 2_656 . O2 N3 O1 87.3(8) . . O2 N3 O1 87.3(8) 2_656 2_656 O2 N3 O1 149.1(7) . 2_656 O1 N3 O1 101.0(12) . 2_656 O4 N4 O3 120.1(2) . . O4 N4 O3 120.1(2) . 2_655 O3 N4 O3 119.7(4) . 2_655 N3 O1 O2 45.6(5) . . O2 O1 O1 81.6(6) . 2_656 N3 O2 O1 47.1(5) . . O1 O2 O2 83.1(5) . 2_656 N2 Pd1 N2 100.45(11) . 2_655 N2 Pd1 N1 81.04(9) . . N2 Pd1 N1 165.53(9) 2_655 . N2 Pd1 N1 165.53(9) . 2_655 N2 Pd1 N1 81.05(9) 2_655 2_655 N1 Pd1 N1 101.15(14) . 2_655 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_2 C1 N1 1.330(4) . C1 C2 1.405(5) . C1 H1 0.9300 . C2 C3 1.359(6) . C2 H2 0.9300 . C3 C4 1.408(5) . C3 H3 0.9300 . C4 C12 1.402(4) . C4 C5 1.428(5) . C5 C6 1.347(5) . C5 H5 0.9300 . C6 C7 1.432(4) . C6 H6 0.9300 . C7 C11 1.402(4) . C7 C8 1.407(4) . C8 C9 1.364(4) . C8 H8 0.9300 . C9 C10 1.400(4) . C9 H9 0.9300 . C10 N2 1.330(3) . C10 H10 0.9300 . C11 N2 1.369(3) . C11 C12 1.421(4) . C12 N1 1.365(4) . N1 Pd1 2.042(2) . N2 Pd1 2.041(2) . N3 O2 1.129(7) 2_656 N3 O2 1.129(7) . N3 O1 1.159(6) . N3 O1 1.159(6) 2_656 N4 O4 1.238(5) . N4 O3 1.238(3) . N4 O3 1.238(3) 2_655 O1 O2 1.580(13) . O1 O1 1.788(15) 2_656 O2 O2 1.740(18) 2_656 Pd1 N2 2.041(2) 2_655 Pd1 N1 2.043(2) 2_655 loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA _geom_hbond_site_symmetry_A C1 H1 O2 0.93 2.57 3.082(10) 115.0 5_656 C2 H2 O2 0.93 2.43 3.011(9) 120.8 5_656 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 _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_4 N1 C1 C2 C3 0.9(5) . . C1 C2 C3 C4 2.3(5) . . C2 C3 C4 C12 -2.0(5) . . C2 C3 C4 C5 177.7(3) . . C12 C4 C5 C6 0.2(4) . . C3 C4 C5 C6 -179.5(3) . . C4 C5 C6 C7 0.1(5) . . C5 C6 C7 C11 1.3(4) . . C5 C6 C7 C8 -177.0(3) . . C11 C7 C8 C9 -1.4(4) . . C6 C7 C8 C9 177.0(3) . . C7 C8 C9 C10 3.2(4) . . C8 C9 C10 N2 -0.7(4) . . C8 C7 C11 N2 -3.0(4) . . C6 C7 C11 N2 178.5(2) . . C8 C7 C11 C12 175.3(2) . . C6 C7 C11 C12 -3.2(4) . . C3 C4 C12 N1 -1.5(4) . . C5 C4 C12 N1 178.8(3) . . C3 C4 C12 C11 177.7(3) . . C5 C4 C12 C11 -2.0(4) . . N2 C11 C12 N1 1.2(3) . . C7 C11 C12 N1 -177.2(2) . . N2 C11 C12 C4 -178.0(2) . . C7 C11 C12 C4 3.6(4) . . C2 C1 N1 C12 -4.2(4) . . C2 C1 N1 Pd1 -176.6(2) . . C4 C12 N1 C1 4.6(4) . . C11 C12 N1 C1 -174.6(2) . . C4 C12 N1 Pd1 178.1(2) . . C11 C12 N1 Pd1 -1.1(3) . . C9 C10 N2 C11 -3.6(4) . . C9 C10 N2 Pd1 -174.3(2) . . C7 C11 N2 C10 5.5(4) . . C12 C11 N2 C10 -172.9(2) . . C7 C11 N2 Pd1 177.72(19) . . C12 C11 N2 Pd1 -0.7(3) . . O2 N3 O1 O2 107(2) 2_656 . O1 N3 O1 O2 -150.0(6) 2_656 . O2 N3 O1 O1 -103(2) 2_656 2_656 O2 N3 O1 O1 150.0(6) . 2_656 O2 N3 O2 O1 -150.0(7) 2_656 . O1 N3 O2 O1 107(2) 2_656 . O1 N3 O2 O2 150.0(7) . 2_656 O1 N3 O2 O2 -103.0(18) 2_656 2_656 O1 O1 O2 N3 -18.7(5) 2_656 . N3 O1 O2 O2 -18.8(6) . 2_656 O1 O1 O2 O2 -37.5(8) 2_656 2_656