#------------------------------------------------------------------------------
#$Date: 2019-09-20 03:43:04 +0300 (Fri, 20 Sep 2019) $
#$Revision: 218560 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/39/7233972.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_7233972
loop_
_publ_author_name
'Yue, Qi'
'Wang, Yuan-Yuan'
'Hu, Xiao-Lu'
'Guo, Wei-Xiao'
'Gao, En-Qing'
_publ_section_title
;
 Eight coordination compounds assembled from unexplored semi-rigid
 ether-based unsymmetrical tetracarboxylate and various dipyridyl ligands:
 structural variation, magnetic and photoluminescence properties
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/C9CE01128E
_journal_year                    2019
_chemical_formula_sum            'C28 H20 Cu2 N2 O15'
_chemical_formula_weight         751.54
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2019-07-16 deposited with the CCDC.    2019-09-18 downloaded from the CCDC.
;
_cell_angle_alpha                90.9880(10)
_cell_angle_beta                 93.6710(10)
_cell_angle_gamma                100.6850(10)
_cell_formula_units_Z            2
_cell_length_a                   11.2403(4)
_cell_length_b                   11.5984(5)
_cell_length_c                   11.8532(5)
_cell_measurement_reflns_used    4880
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.86
_cell_measurement_theta_min      2.32
_cell_volume                     1514.72(11)
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0373
_diffrn_reflns_av_unetI/netI     0.0416
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.988
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            19259
_diffrn_reflns_point_group_measured_fraction_full 0.992
_diffrn_reflns_point_group_measured_fraction_max 0.988
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.998
_diffrn_reflns_theta_min         1.722
_exptl_absorpt_coefficient_mu    1.482
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.648
_exptl_crystal_description       rodlike
_exptl_crystal_F_000             760
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.14
_refine_diff_density_max         0.586
_refine_diff_density_min         -0.330
_refine_diff_density_rms         0.082
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     440
_refine_ls_number_reflns         5893
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.025
_refine_ls_R_factor_all          0.0566
_refine_ls_R_factor_gt           0.0385
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0556P)²+1.1824P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0968
_refine_ls_wR_factor_ref         0.1095
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4558
_reflns_number_total             5893
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9ce01128e2.cif
_cod_data_source_block           7
_cod_database_code               7233972
_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           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
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
Cu1 Cu 0.17179(3) 0.60146(3) 0.42778(3) 0.02508(12) Uani 1 1 d . .
Cu2 Cu -0.09610(3) 0.71310(3) 0.24857(3) 0.02518(12) Uani 1 1 d . .
O1 O 0.2171(2) 0.7627(2) 0.3919(2) 0.0292(5) Uani 1 1 d . .
O2 O 0.4170(2) 0.7990(3) 0.4276(3) 0.0551(8) Uani 1 1 d . .
O3 O 0.0559(2) 0.80571(19) 0.19989(19) 0.0279(5) Uani 1 1 d . .
O4 O 0.0314(2) 0.9023(2) 0.3561(2) 0.0380(6) Uani 1 1 d . .
O5 O 0.1166(2) 1.0822(2) 0.1543(2) 0.0338(6) Uani 1 1 d . .
O6 O -0.0860(2) 1.3455(2) 0.4446(2) 0.0331(6) Uani 1 1 d . .
O7 O 0.1060(2) 1.43910(19) 0.46800(18) 0.0271(5) Uani 1 1 d . .
O8 O -0.0120(2) 1.57954(19) 0.28599(19) 0.0268(5) Uani 1 1 d . .
O9 O -0.1368(3) 1.5269(2) 0.1354(2) 0.0450(7) Uani 1 1 d . .
O10 O 0.3445(3) 0.6109(3) 0.5633(3) 0.0499(7) Uani 1 1 d D .
H10B H 0.338(5) 0.618(3) 0.6335(19) 0.11(2) Uiso 1 1 d D .
H10C H 0.386(6) 0.676(3) 0.544(5) 0.14(3) Uiso 1 1 d D .
O11 O -0.2219(2) 0.6458(3) 0.3473(2) 0.0401(6) Uani 1 1 d D .
H11A H -0.262(5) 0.690(4) 0.381(5) 0.11(2) Uiso 1 1 d D .
H11B H -0.202(4) 0.604(3) 0.400(3) 0.045(12) Uiso 1 1 d D .
O12 O 0.1606(3) 0.0187(4) 0.5499(3) 0.0789(12) Uani 1 1 d . .
O13 O 0.3397(3) 0.2152(4) 0.5492(4) 0.0931(14) Uani 1 1 d . .
O14 O 0.2482(4) 0.8404(3) 0.6776(3) 0.0860(12) Uani 1 1 d D .
O15 O 0.6807(4) 0.3169(4) 0.1784(5) 0.1146(17) Uani 1 1 d . .
N1 N 0.2692(3) 0.5550(3) 0.3053(2) 0.0302(7) Uani 1 1 d . .
N2 N -0.2047(2) 0.8113(2) 0.1730(2) 0.0291(6) Uani 1 1 d . .
C1 C 0.3214(3) 0.8245(3) 0.3875(3) 0.0309(8) Uani 1 1 d . .
C2 C 0.3236(3) 0.9373(3) 0.3251(3) 0.0294(8) Uani 1 1 d . .
C3 C 0.2163(3) 0.9601(3) 0.2706(3) 0.0260(7) Uani 1 1 d . .
C4 C 0.0941(3) 0.8827(3) 0.2779(3) 0.0266(7) Uani 1 1 d . .
C5 C 0.2226(3) 1.0653(3) 0.2140(3) 0.0302(8) Uani 1 1 d . .
C6 C 0.3285(4) 1.1454(3) 0.2122(4) 0.0422(10) Uani 1 1 d . .
H6A H 0.3302 1.2150 0.1739 0.051 Uiso 1 1 calc R U
C7 C 0.4328(4) 1.1221(3) 0.2675(4) 0.0487(11) Uani 1 1 d . .
H7A H 0.5048 1.1766 0.2674 0.058 Uiso 1 1 calc R U
C8 C 0.4306(3) 1.0184(3) 0.3230(4) 0.0416(9) Uani 1 1 d . .
H8A H 0.5014 1.0027 0.3593 0.050 Uiso 1 1 calc R U
C9 C 0.0792(3) 1.1882(3) 0.1714(3) 0.0295(8) Uani 1 1 d . .
C10 C 0.0785(3) 1.2370(3) 0.2787(3) 0.0290(7) Uani 1 1 d . .
H10A H 0.1089 1.2020 0.3415 0.035 Uiso 1 1 calc R U
C11 C 0.0315(3) 1.3393(3) 0.2913(3) 0.0231(7) Uani 1 1 d . .
C12 C 0.0162(3) 1.3798(3) 0.4102(3) 0.0241(7) Uani 1 1 d . .
C13 C -0.0122(3) 1.3933(3) 0.1972(3) 0.0251(7) Uani 1 1 d . .
C14 C -0.0580(3) 1.5061(3) 0.2059(3) 0.0275(7) Uani 1 1 d . .
C15 C -0.0121(3) 1.3409(3) 0.0908(3) 0.0337(8) Uani 1 1 d . .
H15A H -0.0427 1.3751 0.0276 0.040 Uiso 1 1 calc R U
C16 C 0.0331(3) 1.2381(3) 0.0776(3) 0.0346(8) Uani 1 1 d . .
H16A H 0.0322 1.2034 0.0062 0.042 Uiso 1 1 calc R U
C17 C 0.3537(3) 0.4897(3) 0.3256(3) 0.0385(9) Uani 1 1 d . .
H17A H 0.3624 0.4595 0.3972 0.046 Uiso 1 1 calc R U
C18 C 0.2568(3) 0.5960(3) 0.2010(3) 0.0356(8) Uani 1 1 d . .
H18A H 0.1983 0.6418 0.1858 0.043 Uiso 1 1 calc R U
C19 C 0.4286(4) 0.4651(3) 0.2443(3) 0.0412(9) Uani 1 1 d . .
H19A H 0.4875 0.4205 0.2624 0.049 Uiso 1 1 calc R U
C20 C 0.3269(3) 0.5730(4) 0.1159(3) 0.0394(9) Uani 1 1 d . .
H20A H 0.3144 0.6021 0.0443 0.047 Uiso 1 1 calc R U
C21 C 0.4167(3) 0.5063(3) 0.1365(3) 0.0367(9) Uani 1 1 d . .
C22 C 0.4980(4) 0.4803(4) 0.0510(3) 0.0419(9) Uani 1 1 d . .
H22A H 0.5517 0.4310 0.0718 0.050 Uiso 1 1 calc R U
C23 C -0.3211(4) 0.7661(4) 0.1494(4) 0.0610(14) Uani 1 1 d . .
H23A H -0.3495 0.6888 0.1680 0.073 Uiso 1 1 calc R U
C24 C -0.1678(3) 0.9214(3) 0.1447(3) 0.0388(9) Uani 1 1 d . .
H24A H -0.0865 0.9549 0.1599 0.047 Uiso 1 1 calc R U
C25 C -0.4018(4) 0.8286(4) 0.0985(5) 0.0713(16) Uani 1 1 d . .
H25A H -0.4826 0.7931 0.0835 0.086 Uiso 1 1 calc R U
C26 C -0.2439(4) 0.9891(3) 0.0936(4) 0.0444(10) Uani 1 1 d . .
H26A H -0.2132 1.0662 0.0757 0.053 Uiso 1 1 calc R U
C27 C -0.3633(3) 0.9433(3) 0.0697(3) 0.0415(9) Uani 1 1 d . .
C28 C -0.4437(4) 1.0153(4) 0.0152(4) 0.0509(11) Uani 1 1 d . .
H28A H -0.4084 1.0923 0.0012 0.061 Uiso 1 1 calc R U
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'
Cu Cu 0.3201 1.2651 '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'
H H 0.0000 0.0000 '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
O1 Cu1 O7 173.24(9) . 1_545
O1 Cu1 O6 87.41(10) . 2_576
O7 Cu1 O6 87.53(9) 1_545 2_576
O1 Cu1 N1 90.63(11) . .
O7 Cu1 N1 94.70(11) 1_545 .
O6 Cu1 N1 175.76(11) 2_576 .
O1 Cu1 O10 92.77(11) . .
O7 Cu1 O10 91.39(10) 1_545 .
O6 Cu1 O10 86.25(11) 2_576 .
N1 Cu1 O10 90.09(12) . .
O11 Cu2 O3 160.00(11) . .
O11 Cu2 N2 91.67(11) . .
O3 Cu2 N2 95.58(11) . .
O11 Cu2 O8 88.11(10) . 1_545
O3 Cu2 O8 90.58(9) . 1_545
N2 Cu2 O8 162.16(10) . 1_545
C1 O1 Cu1 129.4(2) . .
C4 O3 Cu2 106.2(2) . .
C9 O5 C5 117.6(3) . .
C12 O6 Cu1 132.8(2) . 2_576
C12 O7 Cu1 120.1(2) . 1_565
C14 O8 Cu2 100.45(19) . 1_565
Cu1 O10 H10B 121(4) . .
Cu1 O10 H10C 99(5) . .
H10B O10 H10C 106(3) . .
Cu2 O11 H11A 120(4) . .
Cu2 O11 H11B 117(3) . .
H11A O11 H11B 102(5) . .
C17 N1 C18 117.8(3) . .
C17 N1 Cu1 121.8(2) . .
C18 N1 Cu1 120.2(2) . .
C24 N2 C23 116.5(3) . .
C24 N2 Cu2 123.9(2) . .
C23 N2 Cu2 119.6(3) . .
O2 C1 O1 125.6(3) . .
O2 C1 C2 120.1(3) . .
O1 C1 C2 114.3(3) . .
C8 C2 C3 120.2(3) . .
C8 C2 C1 120.2(3) . .
C3 C2 C1 119.7(3) . .
C5 C3 C2 117.7(3) . .
C5 C3 C4 118.4(3) . .
C2 C3 C4 123.7(3) . .
O4 C4 O3 122.7(3) . .
O4 C4 C3 118.3(3) . .
O3 C4 C3 118.8(3) . .
C6 C5 O5 121.5(3) . .
C6 C5 C3 122.0(3) . .
O5 C5 C3 116.4(3) . .
C5 C6 C7 119.5(4) . .
C5 C6 H6A 120.3 . .
C7 C6 H6A 120.3 . .
C8 C7 C6 120.2(4) . .
C8 C7 H7A 119.9 . .
C6 C7 H7A 119.9 . .
C7 C8 C2 120.4(4) . .
C7 C8 H8A 119.8 . .
C2 C8 H8A 119.8 . .
C16 C9 C10 121.1(3) . .
C16 C9 O5 116.9(3) . .
C10 C9 O5 121.7(3) . .
C9 C10 C11 119.1(3) . .
C9 C10 H10A 120.5 . .
C11 C10 H10A 120.5 . .
C13 C11 C10 120.7(3) . .
C13 C11 C12 121.7(3) . .
C10 C11 C12 117.2(3) . .
O6 C12 O7 125.5(3) . .
O6 C12 C11 114.8(3) . .
O7 C12 C11 119.6(3) . .
C15 C13 C11 118.7(3) . .
C15 C13 C14 118.6(3) . .
C11 C13 C14 122.7(3) . .
O9 C14 O8 122.0(3) . .
O9 C14 C13 119.8(3) . .
O8 C14 C13 118.3(3) . .
C16 C15 C13 120.9(3) . .
C16 C15 H15A 119.5 . .
C13 C15 H15A 119.5 . .
C9 C16 C15 119.4(3) . .
C9 C16 H16A 120.3 . .
C15 C16 H16A 120.3 . .
N1 C17 C19 122.4(3) . .
N1 C17 H17A 118.8 . .
C19 C17 H17A 118.8 . .
N1 C18 C20 122.6(3) . .
N1 C18 H18A 118.7 . .
C20 C18 H18A 118.7 . .
C17 C19 C21 120.5(3) . .
C17 C19 H19A 119.8 . .
C21 C19 H19A 119.8 . .
C18 C20 C21 120.1(3) . .
C18 C20 H20A 120.0 . .
C21 C20 H20A 120.0 . .
C19 C21 C20 116.5(3) . .
C19 C21 C22 119.8(3) . .
C20 C21 C22 123.6(4) . .
C22 C22 C21 126.1(5) 2_665 .
C22 C22 H22A 116.9 2_665 .
C21 C22 H22A 116.9 . .
N2 C23 C25 123.0(4) . .
N2 C23 H23A 118.5 . .
C25 C23 H23A 118.5 . .
N2 C24 C26 123.5(4) . .
N2 C24 H24A 118.2 . .
C26 C24 H24A 118.2 . .
C27 C25 C23 120.3(4) . .
C27 C25 H25A 119.8 . .
C23 C25 H25A 119.8 . .
C27 C26 C24 120.1(4) . .
C27 C26 H26A 119.9 . .
C24 C26 H26A 119.9 . .
C26 C27 C25 116.5(3) . .
C26 C27 C28 120.0(4) . .
C25 C27 C28 123.5(4) . .
C28 C28 C27 127.6(5) 2_475 .
C28 C28 H28A 116.2 2_475 .
C27 C28 H28A 116.2 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Cu1 O1 1.908(2) .
Cu1 O7 1.970(2) 1_545
Cu1 O6 1.993(2) 2_576
Cu1 N1 1.998(3) .
Cu1 O10 2.424(3) .
Cu2 O11 1.952(3) .
Cu2 O3 1.968(2) .
Cu2 N2 2.000(3) .
Cu2 O8 2.001(2) 1_545
O1 C1 1.260(4) .
O2 C1 1.236(4) .
O3 C4 1.271(4) .
O4 C4 1.242(4) .
O5 C9 1.387(4) .
O5 C5 1.394(4) .
O6 C12 1.241(4) .
O6 Cu1 1.993(2) 2_576
O7 C12 1.264(4) .
O7 Cu1 1.970(2) 1_565
O8 C14 1.280(4) .
O8 Cu2 2.001(2) 1_565
O9 C14 1.238(4) .
O10 H10B 0.845(19) .
O10 H10C 0.85(2) .
O11 H11A 0.86(2) .
O11 H11B 0.839(19) .
N1 C17 1.333(4) .
N1 C18 1.340(4) .
N2 C24 1.323(5) .
N2 C23 1.326(5) .
C1 C2 1.511(5) .
C2 C8 1.384(5) .
C2 C3 1.402(5) .
C3 C5 1.395(5) .
C3 C4 1.504(5) .
C5 C6 1.369(5) .
C6 C7 1.379(6) .
C6 H6A 0.9300 .
C7 C8 1.378(5) .
C7 H7A 0.9300 .
C8 H8A 0.9300 .
C9 C16 1.379(5) .
C9 C10 1.384(5) .
C10 C11 1.395(4) .
C10 H10A 0.9300 .
C11 C13 1.394(4) .
C11 C12 1.509(4) .
C13 C15 1.391(5) .
C13 C14 1.496(4) .
C15 C16 1.389(5) .
C15 H15A 0.9300 .
C16 H16A 0.9300 .
C17 C19 1.379(5) .
C17 H17A 0.9300 .
C18 C20 1.371(5) .
C18 H18A 0.9300 .
C19 C21 1.379(5) .
C19 H19A 0.9300 .
C20 C21 1.395(5) .
C20 H20A 0.9300 .
C21 C22 1.471(5) .
C22 C22 1.301(8) 2_665
C22 H22A 0.9300 .
C23 C25 1.379(6) .
C23 H23A 0.9300 .
C24 C26 1.383(5) .
C24 H24A 0.9300 .
C25 C27 1.376(6) .
C25 H25A 0.9300 .
C26 C27 1.359(5) .
C26 H26A 0.9300 .
C27 C28 1.468(5) .
C28 C28 1.276(8) 2_475
C28 H28A 0.9300 .
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
Cu1 O1 C1 O2 -15.4(6) . .
Cu1 O1 C1 C2 163.6(2) . .
O2 C1 C2 C8 -6.9(5) . .
O1 C1 C2 C8 174.0(3) . .
O2 C1 C2 C3 173.9(3) . .
O1 C1 C2 C3 -5.2(5) . .
C8 C2 C3 C5 0.9(5) . .
C1 C2 C3 C5 -180.0(3) . .
C8 C2 C3 C4 -173.9(3) . .
C1 C2 C3 C4 5.2(5) . .
Cu2 O3 C4 O4 -11.0(4) . .
Cu2 O3 C4 C3 173.9(2) . .
C5 C3 C4 O4 -85.7(4) . .
C2 C3 C4 O4 89.1(4) . .
C5 C3 C4 O3 89.6(4) . .
C2 C3 C4 O3 -95.7(4) . .
C9 O5 C5 C6 -52.3(4) . .
C9 O5 C5 C3 130.9(3) . .
C2 C3 C5 C6 -1.0(5) . .
C4 C3 C5 C6 174.1(3) . .
C2 C3 C5 O5 175.8(3) . .
C4 C3 C5 O5 -9.1(4) . .
O5 C5 C6 C7 -176.5(3) . .
C3 C5 C6 C7 0.1(6) . .
C5 C6 C7 C8 0.8(6) . .
C6 C7 C8 C2 -0.9(6) . .
C3 C2 C8 C7 0.0(6) . .
C1 C2 C8 C7 -179.1(4) . .
C5 O5 C9 C16 140.1(3) . .
C5 O5 C9 C10 -45.2(5) . .
C16 C9 C10 C11 -0.8(5) . .
O5 C9 C10 C11 -175.3(3) . .
C9 C10 C11 C13 -1.2(5) . .
C9 C10 C11 C12 171.6(3) . .
Cu1 O6 C12 O7 20.9(5) 2_576 .
Cu1 O6 C12 C11 -162.6(2) 2_576 .
Cu1 O7 C12 O6 -113.9(3) 1_565 .
Cu1 O7 C12 C11 69.8(3) 1_565 .
C13 C11 C12 O6 78.8(4) . .
C10 C11 C12 O6 -93.8(4) . .
C13 C11 C12 O7 -104.5(4) . .
C10 C11 C12 O7 82.8(4) . .
C10 C11 C13 C15 2.3(5) . .
C12 C11 C13 C15 -170.2(3) . .
C10 C11 C13 C14 -177.1(3) . .
C12 C11 C13 C14 10.5(5) . .
Cu2 O8 C14 O9 -2.8(4) 1_565 .
Cu2 O8 C14 C13 175.9(2) 1_565 .
C15 C13 C14 O9 29.6(5) . .
C11 C13 C14 O9 -151.1(3) . .
C15 C13 C14 O8 -149.2(3) . .
C11 C13 C14 O8 30.2(5) . .
C11 C13 C15 C16 -1.5(5) . .
C14 C13 C15 C16 177.9(3) . .
C10 C9 C16 C15 1.6(6) . .
O5 C9 C16 C15 176.4(3) . .
C13 C15 C16 C9 -0.5(6) . .
C18 N1 C17 C19 1.0(6) . .
Cu1 N1 C17 C19 -174.4(3) . .
C17 N1 C18 C20 0.2(6) . .
Cu1 N1 C18 C20 175.7(3) . .
N1 C17 C19 C21 -1.3(7) . .
N1 C18 C20 C21 -1.1(6) . .
C17 C19 C21 C20 0.3(6) . .
C17 C19 C21 C22 179.5(4) . .
C18 C20 C21 C19 0.8(6) . .
C18 C20 C21 C22 -178.3(4) . .
C19 C21 C22 C22 -175.3(5) . 2_665
C20 C21 C22 C22 3.8(8) . 2_665
C24 N2 C23 C25 -0.3(7) . .
Cu2 N2 C23 C25 179.3(4) . .
C23 N2 C24 C26 0.4(6) . .
Cu2 N2 C24 C26 -179.2(3) . .
N2 C23 C25 C27 -0.1(9) . .
N2 C24 C26 C27 -0.2(7) . .
C24 C26 C27 C25 -0.2(7) . .
C24 C26 C27 C28 -179.8(4) . .
C23 C25 C27 C26 0.3(8) . .
C23 C25 C27 C28 179.9(5) . .
C26 C27 C28 C28 178.1(6) . 2_475
C25 C27 C28 C28 -1.5(10) . 2_475
