data_5000301
_chemical_formula_moiety         ?
_chemical_formula_sum            'C22 H38 Cl2 Cu2 N6'
_chemical_formula_weight         584.582
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90
_cell_angle_beta                 97.2911(12)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.2933(3)
_cell_length_b                   15.1724(4)
_cell_length_c                   17.7016(5)
_cell_measurement_reflns_used    7259
_cell_measurement_temperature    113(2)
_cell_measurement_theta_max      29.96
_cell_measurement_theta_min      2.43
_cell_volume                     2742.18(13)
_diffrn_ambient_temperature      113(2)
_diffrn_detector                 'CCD area detector'
_diffrn_detector_area_resol_mean 44.52
_diffrn_detector_type            'Bruker SMART 6000'
_diffrn_measured_fraction_theta_full 1
_diffrn_measured_fraction_theta_max 1
_diffrn_measurement_details
'   0.30 degree frames measured for   3.16 seconds each'
_diffrn_measurement_device       'three-circle goniometer with fixed chi'
_diffrn_measurement_device_type  'Bruker Platform goniometer'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  9576
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            3
_diffrn_reflns_theta_full        30.0253
_diffrn_reflns_theta_max         30.0253
_diffrn_reflns_theta_min         1.99611
_diffrn_standards_decay_%        0.
_diffrn_standards_interval_time  67
_diffrn_standards_number         7260
_exptl_absorpt_coefficient_mu    1.7666
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.416
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             1216
_exptl_crystal_size_max          .30
_exptl_crystal_size_mid          .30
_exptl_crystal_size_min          .25
_refine_diff_density_max         0.47
_refine_diff_density_min         -0.31
_refine_ls_abs_structure_details none
_refine_ls_abs_structure_Flack   ?
_refine_ls_extinction_coef       -0.00000015(3)
_refine_ls_extinction_expression
;
Larson, A. C. (1967).  Acta Cryst. 23, p. 664.  Eq. (3)
;
_refine_ls_extinction_method     Zachariasen
_refine_ls_goodness_of_fit_ref   0.6352
_refine_ls_hydrogen_treatment    ?
_refine_ls_matrix_type           full
_refine_ls_number_parameters     578
_refine_ls_number_reflns         9576
_refine_ls_R_factor_gt           0.0293
_refine_ls_shift/su_max          0.0011
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     w^-1^=\s^2^(F)+(.07F)^2^
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0314
_reflns_number_gt                9576
_reflns_number_total             12503
_reflns_threshold_expression     'Fo^2^> 2.00\s(Fo^2^)'
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               5000301