Synthesis and characterization of new ruthenium(II) complexes containing diisopropylmethylphosphine
Bustelo, Emilio; Jiménez-Tenorio, Manuel; Puerta, Ma Carmen; Valerga, Pedro; Journal of the Chemical Society, Dalton Transactions  (1999) 2399–; doi:10.1039/a902065i

data_7027389
_publ_contact_author
;
 M.Carmen Puerta 
 Departamento de Ciencia de los Materiales e
 Ingenieria Metalurgica y Quimica Inorganica
 Universidad de Cadiz
 Apartado 40. Puerto Real 11510.
 Spain
;
_publ_section_title
;
 Synthesis and characterization of new ruthenium(II) complexes containing
 diisopropylmethylphosphine
;
_journal_issue                   14
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              2399
_journal_paper_doi               10.1039/a902065i
_journal_year                    1999
_chemical_formula_moiety         'C28 H45 Cl2 N O P2 Ru '
_chemical_formula_sum            'C28 H45 Cl2 N O P2 Ru'
_chemical_formula_weight         645.59
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      4
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_audit_creation_date             'Tue Jan 20 14:57:18 1998'
_audit_creation_method           'from TEXRAY.INF file'
_cell_angle_alpha                90
_cell_angle_beta                 104.65(3)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.204(4)
_cell_length_b                   17.129(4)
_cell_length_c                   10.041(4)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    290.2
_cell_measurement_theta_max      15.5
_cell_measurement_theta_min      12.5
_cell_volume                     1531.6(10)
_computing_cell_refinement       'MSC/AFC Diffractometer Control'
_computing_data_collection       'MSC/AFC Diffractometer Control'
_computing_data_reduction        teXsan
_computing_publication_material  teXsan
_computing_structure_refinement  teXsan
_diffrn_ambient_temperature      290.2
_diffrn_measurement_device       AFC6S
_diffrn_measurement_method       'omega/2-theta scans'
_diffrn_orient_matrix_UB_11      0.10353
_diffrn_orient_matrix_UB_12      -0.01155
_diffrn_orient_matrix_UB_13      0.05718
_diffrn_orient_matrix_UB_21      0.04338
_diffrn_orient_matrix_UB_22      0.03139
_diffrn_orient_matrix_UB_23      -0.06459
_diffrn_orient_matrix_UB_31      -0.00346
_diffrn_orient_matrix_UB_32      0.04785
_diffrn_orient_matrix_UB_33      0.05617
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_type           MoKalpha
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  14.31
_diffrn_reflns_number            2915
_diffrn_reflns_theta_max         25.05
_diffrn_standards_decay_%        -2.30
_diffrn_standards_interval_count 100
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    0.801
_exptl_absorpt_correction_T_max  1.255
_exptl_absorpt_correction_T_min  0.862
_exptl_absorpt_correction_type   refdelf
_exptl_absorpt_process_details   Walker&Stuart_DIFABS
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.400
_exptl_crystal_density_meas      0.000
_exptl_crystal_description       prism
_exptl_crystal_F_000             672.00
_exptl_crystal_size_max          0.370
_exptl_crystal_size_mid          0.180
_exptl_crystal_size_min          0.100
_refine_diff_density_max         -0.31
_refine_diff_density_min         0.48
_refine_ls_extinction_coef       0.00000
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_obs   1.273
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     315
_refine_ls_number_reflns         2452
_refine_ls_number_restraints     0
_refine_ls_R_factor_obs          0.0289
_refine_ls_shift/esd_max         0.2245
_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_obs         0.0353
_reflns_number_observed          2452
_reflns_number_total             2915
_reflns_observed_criterion       3.00
_cod_data_source_file            902065Isup1.cif
_cod_data_source_block           data
_cod_original_cell_volume        1531.4(9)
_cod_original_sg_symbol_H-M      'P 21       '
_cod_original_formula_sum        'C28 H45 Cl2 N O P2 Ru '
_cod_database_code               7027389