Mixed nitrosyl/phosphinidene and nitrene/phosphinidene clusters of rutheniumElectronic supplementary information (ESI) available: experimental, preparation of compounds. See http://www.rsc.org/suppdata/cc/b1/b110927h
Scoles, Ludmila; Sterenberg, Brian T.; Udachin, Konstantin A.; Carty, Arthur J.; Chemical Communications  (2002) 320–; doi:10.1039/b110927h

data_7114102
_publ_section_title
;
 Mixed nitrosyl/phosphinidene and nitrene/phosphinidene clusters of
 rutheniumElectronic supplementary information (ESI) available:
 experimental, preparation of compounds. See
 http://www.rsc.org/suppdata/cc/b1/b110927h
;
_journal_issue                   4
_journal_name_full               'Chemical Communications'
_journal_page_first              320
_journal_paper_doi               10.1039/b110927h
_journal_year                    2002
_chemical_formula_sum            'C55 H44 N3 O14 P3 Ru5'
_chemical_formula_weight         1569.19
_chemical_name_systematic
; 
? 
;
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                101.7430(10)
_cell_angle_beta                 102.5560(10)
_cell_angle_gamma                97.3690(10)
_cell_formula_units_Z            2
_cell_length_a                   11.0845(7)
_cell_length_b                   16.4630(10)
_cell_length_c                   16.7626(10)
_cell_measurement_temperature    173(2)
_cell_volume                     2875.2(3)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.990
_diffrn_measured_fraction_theta_max 0.990
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.0178
_diffrn_reflns_av_sigmaI/netI    0.0190
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            34264
_diffrn_reflns_theta_full        28.72
_diffrn_reflns_theta_max         28.72
_diffrn_reflns_theta_min         1.28
_exptl_absorpt_coefficient_mu    1.433
_exptl_crystal_density_diffrn    1.813
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1544
_refine_diff_density_max         6.227
_refine_diff_density_min         -3.468
_refine_diff_density_rms         0.106
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     721
_refine_ls_number_reflns         14739
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.020
_refine_ls_R_factor_all          0.0421
_refine_ls_R_factor_gt           0.0351
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0300P)^2^+9.1141P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0811
_refine_ls_wR_factor_ref         0.0855
_reflns_number_gt                12865
_reflns_number_total             14739
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b110927h.txt
_cod_data_source_block           ld37
_cod_database_code               7114102