{μ-<i>N</i>,<i>N</i>'-Bis[3-(dimethylamino)propyl]oxamidato(2–)-κ^6^<i>N</i>,<i>N</i>',<i>O</i>':<i>N</i>'',<i>N</i>''',<i>O</i>}bis[(1<i>H</i>-imidazole-κ<i>N</i>^3^)(methanol-κ<i>O</i>)copper(II)] bis(perchlorate)
Fen Sun; Yan-Tuan Li; Zhi-Yong Wu; Yu-Lan Song; Man Jiang; Acta Crystallographica Section C 62 (2006) m584–m586; doi:10.1107/S0108270106042624

data_2015709
_publ_section_title
;{\m-<i>N</i>,<i>N</i>'-Bis[3-(dimethylamino)propyl]oxamidato(2--)-\k^6^<i>N</i>,<i>N</i>',<i>O</i>':<i>N</i>'',<i>N</i>''',<i>O</i>}bis[(1<i>H</i>-imidazole-\k<i>N</i>^3^)(methanol-\k<i>O</i>)copper(II)]
 bis(perchlorate)
;
_journal_coeditor_code           SQ3043
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              m584
_journal_page_last               m586
_journal_paper_doi               10.1107/S0108270106042624
_journal_volume                  62
_journal_year                    2006
_chemical_formula_iupac
'[Cu2 (C12 H24 N4 O2) (C3 H4 N2)2 (C H4 O)2] (Cl1 O4)2'
_chemical_formula_moiety         'C20 H40 Cu2 N8 O4 2+, 2Cl1 O4 -'
_chemical_formula_sum            'C20 H40 Cl2 Cu2 N8 O12'
_chemical_formula_weight         782.60
_chemical_name_systematic
;
{\m-N,N'-Bis[3-(dimethylamino)propyl]oxamidato(2-)-
\k^6^N,N',O':N'',N''',O}bis[(1H-imidazole-\kN^3^)(methanol-\kO)copper(II)]
bis(perchlorate)
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90.00
_cell_angle_beta                 102.328(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   10.023(3)
_cell_length_b                   13.084(3)
_cell_length_c                   12.317(3)
_cell_measurement_reflns_used    2584
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      27.8005
_cell_measurement_theta_min      2.598
_cell_volume                     1578.0(7)
_computing_cell_refinement       'SAINT (Bruker, 2002)'
_computing_data_collection       'SMART (Bruker, 2002)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'XP (Siemens, 1994)'
_computing_publication_material  'WINGX (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_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  0.0419
_diffrn_reflns_av_sigmaI/netI    0.0476
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -9
_diffrn_reflns_number            8761
_diffrn_reflns_theta_full        26.14
_diffrn_reflns_theta_max         26.14
_diffrn_reflns_theta_min         2.30
_exptl_absorpt_coefficient_mu    1.587
_exptl_absorpt_correction_T_max  0.870
_exptl_absorpt_correction_T_min  0.504
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 2003)'
_exptl_crystal_colour            'dark blue'
_exptl_crystal_density_diffrn    1.647
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             808
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.09
_refine_diff_density_max         0.542
_refine_diff_density_min         -0.333
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.035
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     203
_refine_ls_number_reflns         3121
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.035
_refine_ls_R_factor_all          0.0758
_refine_ls_R_factor_gt           0.0446
_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^)+(0.0512P)^2^+1.6075P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1017
_refine_ls_wR_factor_ref         0.1173
_reflns_number_gt                2201
_reflns_number_total             3121
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            sq3043.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               2015709
_cod_database_fobs_code          2015709