Reactivity of vinylidene complexes of ruthenium with hydrazines and hydroxylamines.
Albertin, Gabriele; Antoniutti, Stefano; Bortoluzzi, Marco; Botter, Alessandra; Castro, Jesús; Dalton transactions (Cambridge, England : 2003) 44 (2015) 3439–3446; doi:10.1039/c4dt03464c

data_7033730
_publ_section_title
;
 Reactivity of vinylidene complexes of ruthenium with hydrazines and
 hydroxylamines.
;
_journal_issue                   7
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3439
_journal_page_last               3446
_journal_paper_doi               10.1039/c4dt03464c
_journal_volume                  44
_journal_year                    2015
_chemical_formula_sum            'C61 H62 B N O3 P2 Ru'
_chemical_formula_weight         1030.94
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           Monoclinic'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2014-11-07 deposited with the CCDC.
2015-01-06 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 110.6802(16)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.8368(8)
_cell_length_b                   13.1629(6)
_cell_length_c                   24.6728(11)
_cell_measurement_reflns_used    9541
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      67.84
_cell_measurement_theta_min      2.66
_cell_volume                     5419.5(4)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.966
_diffrn_measured_fraction_theta_max 0.949
_diffrn_measurement_device_type  'Bruker CCD Smart 6000'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_monochromator  'Incoatec Quazar MX multilayer optics'
_diffrn_radiation_source         'Incoatec I\muS microsource'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0609
_diffrn_reflns_av_sigmaI/netI    0.0259
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            115822
_diffrn_reflns_theta_full        66.50
_diffrn_reflns_theta_max         68.11
_diffrn_reflns_theta_min         2.66
_exptl_absorpt_coefficient_mu    3.241
_exptl_absorpt_correction_T_max  0.7530
_exptl_absorpt_correction_T_min  0.5379
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS V2012/1 (Bruker AXS Inc.)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.264
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2152
_exptl_crystal_size_max          0.203
_exptl_crystal_size_mid          0.085
_exptl_crystal_size_min          0.082
_refine_diff_density_max         0.934
_refine_diff_density_min         -0.381
_refine_diff_density_rms         0.049
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.101
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     625
_refine_ls_number_reflns         9391
_refine_ls_number_restraints     10
_refine_ls_restrained_S_all      1.101
_refine_ls_R_factor_all          0.0433
_refine_ls_R_factor_gt           0.0383
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0552P)^2^+1.7797P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1045
_refine_ls_wR_factor_ref         0.1081
_reflns_number_gt                8150
_reflns_number_total             9391
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4dt03464c3.cif
_cod_data_source_block           4a
_cod_depositor_comments          'Adding full bibliography for 7033730.cif.'
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7033730