<i>cis</i>-Dichlorobis(1-butenyldiphenylphosphine)ruthenium(II)
Blake, A. J.; Easton, T.; Stephenson, T. A.; Acta Crystallographica Section C 48 (1992) 1567–1568; doi:10.1107/S0108270192004955

data_2000732
_publ_section_title
;
 <i>cis</i>-Dichlorobis(1-butenyldiphenylphosphine)ruthenium(II)
;
_journal_issue                   8
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1567
_journal_page_last               1568
_journal_paper_doi               10.1107/S0108270192004955
_journal_volume                  48
_journal_year                    1992
_chemical_formula_sum            'C32 H34 Cl2 P2 Ru'
_chemical_formula_weight         652.5
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_atom_type_scat_source           'inlaid except for Ru (Cromer & Mann, 1968)'
_cell_angle_alpha                90
_cell_angle_beta                 113.30(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.181(3)
_cell_length_b                   14.841(6)
_cell_length_c                   11.598(4)
_cell_measurement_reflns_used    17
_cell_measurement_temperature    298
_cell_measurement_theta_max      21.5
_cell_measurement_theta_min      5.5
_cell_volume                     1451.4(9)
_diffrn_measurement_device       'Sto\"e Stadi-2 two-circle'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.012
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            2726
_diffrn_reflns_theta_max         25
_diffrn_standards_decay_%        .0
_diffrn_standards_interval_count fourth_layer
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    0.80
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.493
_exptl_crystal_description       Block
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.80
_refine_diff_density_min         1.19
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_obs   1.290
_refine_ls_hydrogen_treatment    'H-atom positions calculated.'
_refine_ls_number_parameters     138
_refine_ls_number_reflns         2431
_refine_ls_R_factor_obs          0.0583
_refine_ls_shift/esd_max         0.06
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(F)+0.001F^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.0704
_reflns_number_observed          2431
_reflns_observed_criterion       F>2.0\s(F)
_cod_data_source_file            ha1005.cif
_cod_data_source_block           ha1005a
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'w = 1/[\s^2^(F)+0.001F^2^]' 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)+0.001F^2^]'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        1452
_cod_original_formula_sum        'C32 H34 Cl2 P2 Ru1'
_cod_database_code               2000732