A binuclear copper(II) complex: μ-(4,4'-bipyridine)-<i>N</i>:<i>N</i>'-bis{bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-<i>O</i>,<i>O</i>']copper}
Li, M.-X.; Xu, Z.; You, X.-Z.; Chen, C.-G.; Acta Crystallographica Section C 50 (1994) 1699–1701; doi:10.1107/S0108270194003276

data_2010191
_publ_section_title
;A binuclear copper(II) complex:
 \m-(4,4'-bipyridine)-<i>N</i>:<i>N</i>'-bis{bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato-<i>O</i>,<i>O</i>']copper}
;
_journal_issue                   11
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1699
_journal_page_last               1701
_journal_paper_doi               10.1107/S0108270194003276
_journal_volume                  50
_journal_year                    1994
_chemical_formula_moiety         '[Cu2 (C8 H4 F3 O2 S)4 (C10 H8 N)2]'
_chemical_formula_sum            'C42 H24 Cu2 F12 N2 O8 S4'
_chemical_formula_weight         1167.99
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_type_scat_source           IntTabIV
_cell_angle_alpha                72.45(3)
_cell_angle_beta                 85.20(3)
_cell_angle_gamma                86.06(3)
_cell_formula_units_Z            1
_cell_length_a                   8.547(2)
_cell_length_b                   10.187(4)
_cell_length_c                   13.895(6)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    295
_cell_measurement_theta_max      15
_cell_measurement_theta_min      10
_cell_volume                     1148.3(7)
_diffrn_measurement_device       'Enraf-Nonius CAD-4'
_diffrn_measurement_method       \q-2\q
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.70930
_diffrn_reflns_av_R_equivalents  0.018
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            4695
_diffrn_reflns_theta_max         26
_diffrn_standards_decay_%        <0.6
_diffrn_standards_interval_time  60
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    1.20
_exptl_absorpt_correction_T_max  0.9979
_exptl_absorpt_correction_T_min  0.7729
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            Green
_exptl_crystal_density_diffrn    1.69
_exptl_crystal_density_meas      1.689
_exptl_crystal_description       Prism
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.79
_refine_diff_density_min         -0.09
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_obs   1.52
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     317
_refine_ls_number_reflns         2881
_refine_ls_R_factor_obs          0.056
_refine_ls_shift/esd_max         0.09
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/\s^2^(F~o~)'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.063
_reflns_number_observed          2881
_reflns_number_total             4301
_reflns_observed_criterion       F~o~>=3\s(F~o~)
_cod_data_source_file            hu1025.cif
_cod_data_source_block           hu1025_structure_1_of_1
_cod_depositor_comments
;
 Adding the _atom_site_type_symbol data item.

 Antanas Vaitkus,
 2017-01-29

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value '1/\s^2^(F~o~)' was changed to
'calc'. New tag '_refine_ls_weighting_details' was created. The value
of the new tag was set to 'w = 1/\s^2^(F~o~)'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        1148.2(6)
_cod_database_code               2010191