Bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(triphenylphosphine-<i>P</i>)vinylrhodium(III)
Dunaj-Jurčo, M.; Kettmann, V.; Steinborn, D.; Ludwig, M.; Acta Crystallographica Section C 50 (1994) 1427–1430; doi:10.1107/S0108270194001046

data_2010044
_publ_section_title
Bis(dimethylglyoximato-<i>N</i>,<i>N</i>')(triphenylphosphine-<i>P</i>)vinylrhodium(III)
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1427
_journal_page_last               1430
_journal_paper_doi               10.1107/S0108270194001046
_journal_volume                  50
_journal_year                    1994
_chemical_formula_sum            'C28 H32 N4 O4 P Rh'
_chemical_formula_weight         622.5
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_type_scat_source           IntTabIV
_cell_angle_alpha                90.
_cell_angle_beta                 97.91(4)
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   9.703(5)
_cell_length_b                   11.014(4)
_cell_length_c                   25.218(9)
_cell_measurement_reflns_used    15
_cell_measurement_temperature    295
_cell_measurement_theta_max      15
_cell_measurement_theta_min      7
_cell_volume                     2669(2)
_diffrn_measurement_device       P2~1~
_diffrn_measurement_method       \q/2\q
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.032
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       32
_diffrn_reflns_limit_l_min       -32
_diffrn_reflns_number            6711
_diffrn_reflns_theta_max         27.5
_diffrn_standards_decay_%        .0
_diffrn_standards_interval_count 100
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    0.73
_exptl_absorpt_correction_T_max  1.00
_exptl_absorpt_correction_T_min  0.83
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            brownish-yellow
_exptl_crystal_density_diffrn    1.548
_exptl_crystal_density_meas      1.550(10)
_exptl_crystal_description       prism
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.38
_refine_diff_density_min         -0.43
_refine_ls_goodness_of_fit_obs   1.17
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     343
_refine_ls_number_reflns         4199
_refine_ls_R_factor_obs          0.038
_refine_ls_shift/esd_max         0.08
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(F~o~) + 0.025|F~o~|^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.044
_reflns_number_observed          4199
_reflns_number_total             5950
_reflns_observed_criterion       I>=2\s(I)
_cod_data_source_file            ka1060.cif
_cod_data_source_block           ka1060_structure_1_of_1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'w = 1/[\s^2^(F~o~) +
0.025|F~o~|^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~o~) + 0.025|F~o~|^2^]'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        2669.4(8)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2010044