(Aqua-2κ<i>O</i>)bis(2,2'-bipyridine-1κ^2^<i>N</i>,<i>N</i>'){μ-<i>N</i>-[3-(dimethylamino)propyl]-<i>N</i>'-(2-oxidophenyl)oxamidato(3{-})-1:2κ^2^<i>O</i>,<i>O</i>':κ^4^<i>O</i>'',<i>N</i>,<i>N</i>',<i>N</i>''}copper(II)nickel(II) perchlorate
Yue, Xi-Teng; Nie, Jin-Ju; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei; Acta Crystallographica Section C 67 (2011) m115–m118; doi:10.1107/S0108270111008705

data_2018025
_publ_section_title
;
 (Aqua-2\k<i>O</i>)bis(2,2'-bipyridine-1\k^2^<i>N</i>,<i>N</i>'){\m-<i>N</i>-[3-(dimethylamino)propyl]-<i>N</i>'-(2-oxidophenyl)oxamidato(3{-})-1:2\k^2^<i>O</i>,<i>O</i>':\k^4^<i>O</i>'',<i>N</i>,<i>N</i>',<i>N</i>''}copper(II)nickel(II)
 perchlorate
;
_journal_coeditor_code           BG3135
_journal_issue                   4
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m115
_journal_page_last               m118
_journal_paper_doi               10.1107/S0108270111008705
_journal_volume                  67
_journal_year                    2011
_chemical_formula_iupac
'[Cu Ni (C13 H16 N3 O3) (C10 H8 N2)2 (H2 O)] Cl O4'
_chemical_formula_moiety         'C33 H34 Cu N7 Ni O4 +, Cl O4 -'
_chemical_formula_sum            'C33 H34 Cl Cu N7 Ni O8'
_chemical_formula_weight         814.37
_chemical_name_systematic
;
(Aqua-2\k<i>O</i>)bis(2,2'-bipyridine-1\k^2^<i>N</i>,<i>N</i>'){\m-<i>N</i>-
[3-(dimethylamino)propyl]-<i>N</i>'-(2-oxidophenyl)oxamidato(3-)-
1:2\k^2^<i>O</i>,<i>O</i>':\k^4^<i>O</i>'',<i>N</i>,<i>N</i>',<i>N</i>''}
copper(II)nickel(II) perchlorate
;
_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                92.261(3)
_cell_angle_beta                 109.043(3)
_cell_angle_gamma                112.911(3)
_cell_formula_units_Z            2
_cell_length_a                   11.4692(5)
_cell_length_b                   11.8976(5)
_cell_length_c                   15.1818(7)
_cell_measurement_reflns_used    3159
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      23.256
_cell_measurement_theta_min      2.593
_cell_volume                     1770.51(15)
_computing_cell_refinement       'SAINT (Bruker, 2002)'
_computing_data_collection       'SMART (Bruker, 2002)'
_computing_data_reduction        'SAINT (Bruker, 2002)'
_computing_molecular_graphics    'XP (Siemens, 1994)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_device_type  'Bruker APEX area-detector'
_diffrn_measurement_method       '\f and \w'
_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  0.0437
_diffrn_reflns_av_sigmaI/netI    0.0776
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            15761
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         27.86
_diffrn_reflns_theta_min         2.08
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.268
_exptl_absorpt_correction_T_max  0.8326
_exptl_absorpt_correction_T_min  0.7506
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2002)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.528
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             838
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.456
_refine_diff_density_min         -0.396
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.958
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     515
_refine_ls_number_reflns         8178
_refine_ls_number_restraints     45
_refine_ls_restrained_S_all      0.960
_refine_ls_R_factor_all          0.0992
_refine_ls_R_factor_gt           0.0491
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[\s^2^(Fo^2^)+(0.0597P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1104
_refine_ls_wR_factor_ref         0.1310
_reflns_number_gt                4749
_reflns_number_total             8178
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            bg3135.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               2018025
_cod_database_fobs_code          2018025