#------------------------------------------------------------------------------ #$Date: 2014-07-12 07:06:18 +0300 (Sat, 12 Jul 2014) $ #$Revision: 120112 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/20/58/7205828.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_7205828 loop_ _publ_author_name 'Yuan, Ning' 'Sheng, Tianlu' 'Tian, Chongbin' 'Hu, Shengmin' 'Fu, Ruibiao' 'Zhu, Qilong' 'Tan, Chunhong' 'Wu, Xintao' _publ_section_title ; Syntheses, structures and properties of three-dimensional lanthanide frameworks constructed with a trigonal anti-prismatic lanthanide cluster ; _journal_issue 12 _journal_name_full CrystEngComm _journal_page_first 4244 _journal_volume 13 _journal_year 2011 _chemical_formula_sum 'C72 H49 Eu9 N12 O44' _chemical_formula_weight 3153.87 _chemical_name_systematic ; ? ; _space_group_IT_number 167 _symmetry_cell_setting trigonal _symmetry_space_group_name_Hall '-R 3 2"c' _symmetry_space_group_name_H-M 'R -3 c :H' _atom_sites_solution_hydrogens geom _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _audit_creation_method SHELXL-97 _cell_angle_alpha 90.00 _cell_angle_beta 90.00 _cell_angle_gamma 120.00 _cell_formula_units_Z 6 _cell_length_a 17.0615(4) _cell_length_b 17.0615(4) _cell_length_c 56.505(3) _cell_measurement_reflns_used 11604 _cell_measurement_temperature 293(2) _cell_measurement_theta_max 27.4797 _cell_measurement_theta_min 3.1115 _cell_volume 14244.7(9) _computing_cell_refinement 'CrystalClear (Rigaku/MSC Inc., 2005)' _computing_data_collection 'CrystalClear (Rigaku/MSC Inc., 2005)' _computing_data_reduction 'CrystalClear (Rigaku/MSC Inc., 2005)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 1997)' _computing_structure_solution 'SHELXS-97 (Sheldrick, 1990)' _diffrn_ambient_temperature 293(2) _diffrn_detector_area_resol_mean 14.6306 _diffrn_measured_fraction_theta_full 0.991 _diffrn_measured_fraction_theta_max 0.991 _diffrn_measurement_device_type Mercury70 _diffrn_measurement_method CCD_Profile_fitting _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 0.0363 _diffrn_reflns_av_sigmaI/netI 0.0197 _diffrn_reflns_limit_h_max 22 _diffrn_reflns_limit_h_min -21 _diffrn_reflns_limit_k_max 22 _diffrn_reflns_limit_k_min -22 _diffrn_reflns_limit_l_max 70 _diffrn_reflns_limit_l_min -63 _diffrn_reflns_number 35328 _diffrn_reflns_theta_full 27.48 _diffrn_reflns_theta_max 27.48 _diffrn_reflns_theta_min 2.39 _exptl_absorpt_coefficient_mu 5.944 _exptl_absorpt_correction_T_max 1.0000 _exptl_absorpt_correction_T_min 0.8591 _exptl_absorpt_correction_type multi-scan _exptl_crystal_colour White _exptl_crystal_density_diffrn 2.206 _exptl_crystal_density_method 'not measured' _exptl_crystal_description Prism _exptl_crystal_F_000 8904 _exptl_crystal_size_max 0.2000 _exptl_crystal_size_mid 0.2000 _exptl_crystal_size_min 0.1500 _refine_diff_density_max 1.959 _refine_diff_density_min -6.155 _refine_diff_density_rms 0.258 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_ref 1.004 _refine_ls_hydrogen_treatment geom _refine_ls_matrix_type full _refine_ls_number_parameters 201 _refine_ls_number_reflns 3617 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.004 _refine_ls_R_factor_all 0.0446 _refine_ls_R_factor_gt 0.0432 _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^)+(0.0740P)^2^+656.2661P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.1224 _refine_ls_wR_factor_ref 0.1237 _reflns_number_gt 3503 _reflns_number_total 3617 _reflns_threshold_expression >2sigma(I) _[local]_cod_data_source_file c0ce00848f.txt _[local]_cod_data_source_block a2 _[local]_cod_cif_authors_sg_H-M R-3c _cod_depositor_comments ; The following automatic conversions were performed: '_exptl_absorpt_correction_type' value 'Multi-scan' changed to 'multi-scan' according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29. Automatic conversion script Id: cif_fix_enum 1555 2011-01-17 13:19:09Z saulius ; _cod_original_cell_volume 14244.7(10) _cod_database_code 7205828 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-y, x-y, z' '-x+y, -x, z' 'y, x, -z+1/2' 'x-y, -y, -z+1/2' '-x, -x+y, -z+1/2' 'x+2/3, y+1/3, z+1/3' '-y+2/3, x-y+1/3, z+1/3' '-x+y+2/3, -x+1/3, z+1/3' 'y+2/3, x+1/3, -z+5/6' 'x-y+2/3, -y+1/3, -z+5/6' '-x+2/3, -x+y+1/3, -z+5/6' 'x+1/3, y+2/3, z+2/3' '-y+1/3, x-y+2/3, z+2/3' '-x+y+1/3, -x+2/3, z+2/3' 'y+1/3, x+2/3, -z+7/6' 'x-y+1/3, -y+2/3, -z+7/6' '-x+1/3, -x+y+2/3, -z+7/6' '-x, -y, -z' 'y, -x+y, -z' 'x-y, x, -z' '-y, -x, z-1/2' '-x+y, y, z-1/2' 'x, x-y, z-1/2' '-x+2/3, -y+1/3, -z+1/3' 'y+2/3, -x+y+1/3, -z+1/3' 'x-y+2/3, x+1/3, -z+1/3' '-y+2/3, -x+1/3, z-1/6' '-x+y+2/3, y+1/3, z-1/6' 'x+2/3, x-y+1/3, z-1/6' '-x+1/3, -y+2/3, -z+2/3' 'y+1/3, -x+y+2/3, -z+2/3' 'x-y+1/3, x+2/3, -z+2/3' '-y+1/3, -x+2/3, z+1/6' '-x+y+1/3, y+2/3, z+1/6' 'x+1/3, x-y+2/3, z+1/6' 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 Eu1 Eu 0.21277(2) 0.52782(2) 0.132281(5) 0.01340(12) Uani 1 1 d . . . Eu2 Eu 0.14042(3) 0.3333 0.0833 0.01649(14) Uani 1 2 d S . . C1 C 0.1535(5) 0.3060(4) 0.13621(12) 0.0213(14) Uani 1 1 d . . . C2 C 0.1805(5) 0.3047(5) 0.15986(14) 0.0268(16) Uani 1 1 d . . . C3 C 0.1667(8) 0.2214(6) 0.16830(18) 0.048(3) Uani 1 1 d . . . H3A H 0.1787 0.2162 0.1841 0.057 Uiso 1 1 calc R . . C4 C 0.1358(9) 0.1473(6) 0.1538(2) 0.058(3) Uani 1 1 d . . . H4A H 0.1257 0.0920 0.1596 0.070 Uiso 1 1 calc R . . C5 C 0.1201(7) 0.1574(6) 0.13024(18) 0.041(2) Uani 1 1 d . . . H5A H 0.1033 0.1088 0.1200 0.049 Uiso 1 1 calc R . . C6 C 0.2246(5) 0.3861(5) 0.17485(13) 0.0200(13) Uani 1 1 d . . . C7 C 0.1068(5) 0.4904(5) 0.08179(13) 0.0211(14) Uani 1 1 d . . . C8 C 0.0852(5) 0.5605(5) 0.08302(14) 0.0256(15) Uani 1 1 d . . . C9 C 0.0186(7) 0.5541(7) 0.0686(2) 0.053(3) Uani 1 1 d . . . H9A H 0.0070 0.6018 0.0677 0.064 Uiso 1 1 calc R . . C10 C -0.0339(10) 0.4747(10) 0.0547(3) 0.086(6) Uani 1 1 d . . . H10A H -0.0837 0.4670 0.0460 0.103 Uiso 1 1 calc R . . C11 C -0.0087(9) 0.4112(8) 0.0546(2) 0.070(4) Uani 1 1 d . . . H11A H -0.0396 0.3614 0.0447 0.084 Uiso 1 1 calc R . . C12 C 0.1362(5) 0.6423(4) 0.09824(12) 0.0175(12) Uani 1 1 d . . . O1 O 0.2451(3) 0.4647(3) 0.16646(9) 0.0211(10) Uani 1 1 d . . . O2 O 0.2477(4) 0.3809(4) 0.19551(10) 0.0301(12) Uani 1 1 d . . . O3 O 0.1524(3) 0.3735(3) 0.12650(9) 0.0223(10) Uani 1 1 d . . . O4 O 0.1933(3) 0.6456(3) 0.11370(9) 0.0199(10) Uani 1 1 d . . . O5 O 0.1202(4) 0.7046(3) 0.09503(11) 0.0283(12) Uani 1 1 d . . . O6 O 0.1719(3) 0.4884(3) 0.09301(9) 0.0202(10) Uani 1 1 d . . . O7 O 0.3333 0.6667 0.14428(13) 0.0136(14) Uani 1 3 d S . . H7 H 0.3333 0.6667 0.1667 0.016 Uiso 1 6 d S . . O8 O -0.0714(9) 0.5476(9) -0.0002(2) 0.100 Uiso 1 1 d . . . N1 N 0.1281(5) 0.2349(4) 0.12136(11) 0.0285(14) Uani 1 1 d . . . N2 N 0.0583(5) 0.4163(5) 0.06790(13) 0.0346(17) Uani 1 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 Eu1 0.01460(18) 0.01330(17) 0.0117(2) -0.00115(10) -0.00068(10) 0.00652(13) Eu2 0.01896(19) 0.0135(2) 0.0152(3) -0.00356(16) -0.00178(8) 0.00673(11) C1 0.026(3) 0.013(3) 0.019(3) 0.001(2) 0.001(3) 0.006(3) C2 0.033(4) 0.015(3) 0.028(4) 0.002(3) -0.005(3) 0.009(3) C3 0.081(7) 0.023(4) 0.035(5) 0.002(4) -0.024(5) 0.023(5) C4 0.100(9) 0.023(4) 0.054(7) -0.001(4) -0.024(6) 0.032(5) C5 0.061(6) 0.022(4) 0.038(5) -0.012(3) -0.012(4) 0.019(4) C6 0.019(3) 0.018(3) 0.020(3) 0.000(3) -0.001(3) 0.007(3) C7 0.023(3) 0.020(3) 0.022(4) -0.007(3) -0.007(3) 0.012(3) C8 0.028(4) 0.025(3) 0.027(4) -0.005(3) -0.009(3) 0.015(3) C9 0.056(6) 0.048(6) 0.077(8) -0.036(5) -0.046(6) 0.043(5) C10 0.099(10) 0.078(9) 0.117(12) -0.062(9) -0.089(10) 0.072(8) C11 0.083(9) 0.062(7) 0.090(9) -0.058(7) -0.069(8) 0.054(7) C12 0.019(3) 0.016(3) 0.018(3) 0.000(2) -0.005(2) 0.009(2) O1 0.026(3) 0.014(2) 0.021(2) -0.0041(18) -0.008(2) 0.0088(19) O2 0.044(3) 0.022(3) 0.019(3) 0.001(2) -0.010(2) 0.013(2) O3 0.029(3) 0.012(2) 0.019(2) 0.0004(18) -0.002(2) 0.005(2) O4 0.023(2) 0.018(2) 0.020(3) -0.0019(18) -0.0064(18) 0.0110(19) O5 0.029(3) 0.016(2) 0.041(3) -0.001(2) -0.009(2) 0.012(2) O6 0.027(3) 0.024(2) 0.014(2) -0.0027(19) -0.0050(19) 0.016(2) O7 0.012(2) 0.012(2) 0.017(4) 0.000 0.000 0.0061(10) N1 0.039(4) 0.019(3) 0.022(3) -0.003(2) -0.001(3) 0.010(3) N2 0.042(4) 0.030(3) 0.036(4) -0.019(3) -0.022(3) 0.022(3) 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' Eu Eu -0.1578 3.6682 '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 _geom_angle_publ_flag O3 Eu1 O6 68.79(18) . . ? O3 Eu1 O7 149.27(14) . . ? O6 Eu1 O7 123.9(2) . . ? O3 Eu1 O1 71.12(17) . . ? O6 Eu1 O1 137.76(16) . . ? O7 Eu1 O1 86.45(18) . . ? O3 Eu1 O4 135.23(17) . . ? O6 Eu1 O4 71.44(17) . . ? O7 Eu1 O4 72.62(15) . . ? O1 Eu1 O4 150.76(16) . . ? O3 Eu1 O2 76.94(19) . 26_455 ? O6 Eu1 O2 83.42(18) . 26_455 ? O7 Eu1 O2 129.01(15) . 26_455 ? O1 Eu1 O2 100.12(19) . 26_455 ? O4 Eu1 O2 78.92(19) . 26_455 ? O3 Eu1 O4 86.85(17) . 2_665 ? O6 Eu1 O4 76.57(17) . 2_665 ? O7 Eu1 O4 71.46(15) . 2_665 ? O1 Eu1 O4 88.61(17) . 2_665 ? O4 Eu1 O4 103.2(2) . 2_665 ? O2 Eu1 O4 157.82(17) 26_455 2_665 ? O3 Eu1 O1 109.15(17) . 26_455 ? O6 Eu1 O1 132.04(17) . 26_455 ? O7 Eu1 O1 83.36(18) . 26_455 ? O1 Eu1 O1 74.12(7) . 26_455 ? O4 Eu1 O1 83.18(17) . 26_455 ? O2 Eu1 O1 51.51(16) 26_455 26_455 ? O4 Eu1 O1 150.35(16) 2_665 26_455 ? O3 Eu1 C6 90.63(19) . 26_455 ? O6 Eu1 C6 108.30(19) . 26_455 ? O7 Eu1 C6 108.38(18) . 26_455 ? O1 Eu1 C6 84.68(19) . 26_455 ? O4 Eu1 C6 82.93(18) . 26_455 ? O2 Eu1 C6 25.34(19) 26_455 26_455 ? O4 Eu1 C6 173.28(18) 2_665 26_455 ? O1 Eu1 C6 26.48(17) 26_455 26_455 ? O3 Eu1 C7 76.52(18) . . ? O6 Eu1 C7 18.50(17) . . ? O7 Eu1 C7 125.0(2) . . ? O1 Eu1 C7 147.40(17) . . ? O4 Eu1 C7 59.58(17) . . ? O2 Eu1 C7 68.15(18) 26_455 . ? O4 Eu1 C7 93.58(18) 2_665 . ? O1 Eu1 C7 114.02(17) 26_455 . ? C6 Eu1 C7 91.89(19) 26_455 . ? O3 Eu1 Eu1 171.90(13) . 3_565 ? O6 Eu1 Eu1 103.31(12) . 3_565 ? O7 Eu1 Eu1 34.05(8) . 3_565 ? O1 Eu1 Eu1 116.08(11) . 3_565 ? O4 Eu1 Eu1 39.03(11) . 3_565 ? O2 Eu1 Eu1 104.45(14) 26_455 3_565 ? O4 Eu1 Eu1 89.56(11) 2_665 3_565 ? O1 Eu1 Eu1 77.27(11) 26_455 3_565 ? C6 Eu1 Eu1 93.70(14) 26_455 3_565 ? C7 Eu1 Eu1 96.48(12) . 3_565 ? O3 Eu1 Eu1 119.47(13) . 2_665 ? O6 Eu1 Eu1 105.98(13) . 2_665 ? O7 Eu1 Eu1 34.05(8) . 2_665 ? O1 Eu1 Eu1 82.59(12) . 2_665 ? O4 Eu1 Eu1 90.51(11) . 2_665 ? O2 Eu1 Eu1 163.00(13) 26_455 2_665 ? O4 Eu1 Eu1 37.86(11) 2_665 2_665 ? O1 Eu1 Eu1 114.45(11) 26_455 2_665 ? C6 Eu1 Eu1 140.80(14) 26_455 2_665 ? C7 Eu1 Eu1 117.78(13) . 2_665 ? Eu1 Eu1 Eu1 60.0 3_565 2_665 ? O5 Eu2 O5 71.0(3) 18_544 2_665 ? O5 Eu2 O6 74.12(17) 18_544 17_554 ? O5 Eu2 O6 142.13(18) 2_665 17_554 ? O5 Eu2 O6 142.13(18) 18_544 . ? O5 Eu2 O6 74.12(17) 2_665 . ? O6 Eu2 O6 143.1(2) 17_554 . ? O5 Eu2 O3 69.83(18) 18_544 17_554 ? O5 Eu2 O3 115.72(18) 2_665 17_554 ? O6 Eu2 O3 63.33(16) 17_554 17_554 ? O6 Eu2 O3 114.47(16) . 17_554 ? O5 Eu2 O3 115.73(18) 18_544 . ? O5 Eu2 O3 69.84(18) 2_665 . ? O6 Eu2 O3 114.47(16) 17_554 . ? O6 Eu2 O3 63.33(16) . . ? O3 Eu2 O3 173.7(2) 17_554 . ? O5 Eu2 N2 121.0(2) 18_544 17_554 ? O5 Eu2 N2 144.2(2) 2_665 17_554 ? O6 Eu2 N2 51.66(18) 17_554 17_554 ? O6 Eu2 N2 96.01(19) . 17_554 ? O3 Eu2 N2 99.8(2) 17_554 17_554 ? O3 Eu2 N2 74.96(19) . 17_554 ? O5 Eu2 N2 144.2(2) 18_544 . ? O5 Eu2 N2 121.0(2) 2_665 . ? O6 Eu2 N2 96.01(19) 17_554 . ? O6 Eu2 N2 51.66(18) . . ? O3 Eu2 N2 74.96(19) 17_554 . ? O3 Eu2 N2 99.8(2) . . ? N2 Eu2 N2 71.0(4) 17_554 . ? O5 Eu2 N1 82.1(2) 18_544 17_554 ? O5 Eu2 N1 75.7(2) 2_665 17_554 ? O6 Eu2 N1 113.58(17) 17_554 17_554 ? O6 Eu2 N1 75.47(18) . 17_554 ? O3 Eu2 N1 50.27(17) 17_554 17_554 ? O3 Eu2 N1 131.68(17) . 17_554 ? N2 Eu2 N1 136.1(2) 17_554 17_554 ? N2 Eu2 N1 70.3(2) . 17_554 ? O5 Eu2 N1 75.7(2) 18_544 . ? O5 Eu2 N1 82.1(2) 2_665 . ? O6 Eu2 N1 75.47(18) 17_554 . ? O6 Eu2 N1 113.59(17) . . ? O3 Eu2 N1 131.68(17) 17_554 . ? O3 Eu2 N1 50.28(17) . . ? N2 Eu2 N1 70.3(2) 17_554 . ? N2 Eu2 N1 136.1(2) . . ? N1 Eu2 N1 152.7(3) 17_554 . ? O5 Eu2 C7 97.61(19) 18_544 17_554 ? O5 Eu2 C7 154.6(2) 2_665 17_554 ? O6 Eu2 C7 24.96(17) 17_554 17_554 ? O6 Eu2 C7 120.27(18) . 17_554 ? O3 Eu2 C7 79.11(18) 17_554 17_554 ? O3 Eu2 C7 96.85(18) . 17_554 ? N2 Eu2 C7 26.83(19) 17_554 17_554 ? N2 Eu2 C7 81.8(2) . 17_554 ? N1 Eu2 C7 126.4(2) 17_554 17_554 ? N1 Eu2 C7 72.9(2) . 17_554 ? O5 Eu2 C7 154.6(2) 18_544 . ? O5 Eu2 C7 97.61(19) 2_665 . ? O6 Eu2 C7 120.27(18) 17_554 . ? O6 Eu2 C7 24.96(17) . . ? O3 Eu2 C7 96.85(18) 17_554 . ? O3 Eu2 C7 79.11(18) . . ? N2 Eu2 C7 81.8(2) 17_554 . ? N2 Eu2 C7 26.83(19) . . ? N1 Eu2 C7 72.9(2) 17_554 . ? N1 Eu2 C7 126.4(2) . . ? C7 Eu2 C7 101.1(3) 17_554 . ? O3 C1 N1 113.4(6) . . ? O3 C1 C2 124.5(6) . . ? N1 C1 C2 122.1(7) . . ? O3 C1 Eu2 53.8(3) . . ? N1 C1 Eu2 61.0(4) . . ? C2 C1 Eu2 167.3(5) . . ? C3 C2 C1 116.4(7) . . ? C3 C2 C6 120.5(7) . . ? C1 C2 C6 123.1(6) . . ? C4 C3 C2 121.5(9) . . ? C4 C3 H3A 119.3 . . ? C2 C3 H3A 119.3 . . ? C3 C4 C5 118.0(8) . . ? C3 C4 H4A 121.0 . . ? C5 C4 H4A 121.0 . . ? N1 C5 C4 123.1(8) . . ? N1 C5 H5A 118.5 . . ? C4 C5 H5A 118.5 . . ? O2 C6 O1 119.0(6) . . ? O2 C6 C2 120.1(6) . . ? O1 C6 C2 120.8(6) . . ? O2 C6 Eu1 58.5(4) . 27 ? O1 C6 Eu1 61.6(3) . 27 ? C2 C6 Eu1 165.9(5) . 27 ? O6 C7 N2 112.9(6) . . ? O6 C7 C8 125.9(6) . . ? N2 C7 C8 121.2(7) . . ? O6 C7 Eu2 54.1(3) . . ? N2 C7 Eu2 59.2(4) . . ? C8 C7 Eu2 174.3(6) . . ? O6 C7 Eu1 34.8(3) . . ? N2 C7 Eu1 134.9(5) . . ? C8 C7 Eu1 98.3(4) . . ? Eu2 C7 Eu1 79.37(16) . . ? C9 C8 C7 117.6(7) . . ? C9 C8 C12 119.6(7) . . ? C7 C8 C12 122.8(6) . . ? C8 C9 C10 120.6(8) . . ? C8 C9 H9A 119.7 . . ? C10 C9 H9A 119.7 . . ? C11 C10 C9 117.6(9) . . ? C11 C10 H10A 121.2 . . ? C9 C10 H10A 121.2 . . ? N2 C11 C10 123.5(9) . . ? N2 C11 H11A 118.3 . . ? C10 C11 H11A 118.3 . . ? O5 C12 O4 123.2(6) . . ? O5 C12 C8 116.4(6) . . ? O4 C12 C8 120.4(6) . . ? C6 O1 Eu1 138.9(4) . . ? C6 O1 Eu1 91.9(4) . 27 ? Eu1 O1 Eu1 129.12(19) . 27 ? C6 O2 Eu1 96.2(4) . 27 ? C1 O3 Eu1 139.5(5) . . ? C1 O3 Eu2 101.9(4) . . ? Eu1 O3 Eu2 112.1(2) . . ? C12 O4 Eu1 131.9(4) . . ? C12 O4 Eu1 125.0(4) . 3_565 ? Eu1 O4 Eu1 103.11(17) . 3_565 ? C12 O5 Eu2 141.1(5) . 3_565 ? C7 O6 Eu1 126.7(4) . . ? C7 O6 Eu2 100.9(4) . . ? Eu1 O6 Eu2 113.11(19) . . ? Eu1 O7 Eu1 111.90(16) 3_565 . ? Eu1 O7 Eu1 111.90(16) 3_565 2_665 ? Eu1 O7 Eu1 111.90(16) . 2_665 ? Eu1 O7 H7 106.91(18) 3_565 . ? Eu1 O7 H7 106.91(18) . . ? Eu1 O7 H7 106.91(18) 2_665 . ? C1 N1 C5 118.3(7) . . ? C1 N1 Eu2 92.6(4) . . ? C5 N1 Eu2 148.1(6) . . ? C11 N2 C7 119.3(7) . . ? C11 N2 Eu2 146.5(6) . . ? C7 N2 Eu2 94.0(4) . . ? 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 Eu1 O3 2.321(5) . ? Eu1 O6 2.323(5) . ? Eu1 O7 2.330(2) . ? Eu1 O1 2.406(5) . ? Eu1 O4 2.433(5) . ? Eu1 O2 2.488(5) 26_455 ? Eu1 O4 2.497(5) 2_665 ? Eu1 O1 2.555(5) 26_455 ? Eu1 C6 2.902(7) 26_455 ? Eu1 C7 3.265(7) . ? Eu1 Eu1 3.8615(5) 3_565 ? Eu1 Eu1 3.8615(5) 2_665 ? Eu2 O5 2.385(5) 18_544 ? Eu2 O5 2.385(5) 2_665 ? Eu2 O6 2.483(5) 17_554 ? Eu2 O6 2.483(5) . ? Eu2 O3 2.514(5) 17_554 ? Eu2 O3 2.514(5) . ? Eu2 N2 2.590(7) 17_554 ? Eu2 N2 2.590(7) . ? Eu2 N1 2.670(6) 17_554 ? Eu2 N1 2.670(6) . ? Eu2 C7 3.009(7) 17_554 ? Eu2 C7 3.009(7) . ? C1 O3 1.285(8) . ? C1 N1 1.355(9) . ? C1 C2 1.416(10) . ? C2 C3 1.404(10) . ? C2 C6 1.472(10) . ? C3 C4 1.372(14) . ? C3 H3A 0.9300 . ? C4 C5 1.384(15) . ? C4 H4A 0.9300 . ? C5 N1 1.355(11) . ? C5 H5A 0.9300 . ? C6 O2 1.249(9) . ? C6 O1 1.295(8) . ? C6 Eu1 2.902(7) 27 ? C7 O6 1.293(8) . ? C7 N2 1.361(9) . ? C7 C8 1.418(10) . ? C8 C9 1.359(11) . ? C8 C12 1.493(10) . ? C9 C10 1.428(14) . ? C9 H9A 0.9300 . ? C10 C11 1.351(15) . ? C10 H10A 0.9300 . ? C11 N2 1.335(12) . ? C11 H11A 0.9300 . ? C12 O5 1.236(8) . ? C12 O4 1.289(8) . ? O1 Eu1 2.555(5) 27 ? O2 Eu1 2.488(5) 27 ? O4 Eu1 2.497(5) 3_565 ? O5 Eu2 2.385(5) 3_565 ? O7 Eu1 2.330(2) 3_565 ? O7 Eu1 2.330(2) 2_665 ? O7 H7 1.265(8) . ? _journal_paper_doi 10.1039/c0ce00848f