Reactions of [RuCl2(NO)(terpy)]+ (terpy = 2,2' : 6',2″-terpyridine) with mono anions such as NO2‒, Br‒ and N3‒, and structural studies on terpyridineruthenium having a nitrosyl ligand
Hirano, Toshiyuki; Ueda, Koji; Mukaida, Masao; Nagao, Hirotaka; Oi, Takao; Journal of the Chemical Society, Dalton Transactions  (2001) 2341–; doi:10.1039/b101546j

data_7010644
_publ_section_title
;
 Reactions of [RuCl2(NO)(terpy)]+
 (terpy&#x00A0;=&#x00A0;2,2'&#x00A0;:&#x00A0;6',2&#x2033;-terpyridine)
 with mono anions such as NO2--, Br-- and N3--, and structural studies
 on terpyridineruthenium having a nitrosyl ligand
;
_journal_issue                   16
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              2341
_journal_paper_doi               10.1039/b101546j
_journal_year                    2001
_chemical_formula_sum            'C15 H11 Br2 F6 N4 O P Ru'
_chemical_formula_weight         669.12
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 95.479(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.187(1)
_cell_length_b                   16.638(1)
_cell_length_c                   13.1219(9)
_cell_measurement_reflns_used    14301
_cell_measurement_temperature    298.2
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      2.0
_cell_volume                     1996.6(3)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        'teXsan Ver. 1.10'
_computing_publication_material  'teXsan Ver. 1.10'
_computing_structure_refinement  'teXsan Ver. 1.10'
_computing_structure_solution    SIR92
_diffrn_measured_fraction_theta_full 0.9983
_diffrn_measured_fraction_theta_max 0.9983
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID Imaging Plate'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.055
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            18624
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    4.951
_exptl_absorpt_correction_T_max  0.778
_exptl_absorpt_correction_T_min  0.492
_exptl_absorpt_correction_type   integration
_exptl_crystal_colour            reddish-brown
_exptl_crystal_density_diffrn    2.226
_exptl_crystal_description       chip
_exptl_crystal_F_000             1280.00
_exptl_crystal_size_max          0.170
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.070
_refine_diff_density_max         0.40
_refine_diff_density_min         -0.53
_refine_ls_goodness_of_fit_ref   0.999
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     271
_refine_ls_number_reflns         2934
_refine_ls_R_factor_gt           0.0310
_refine_ls_shift/su_max          0.0015
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(Fo) + 0.00063|Fo|^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0389
_reflns_number_gt                2934
_reflns_number_total             4576
_reflns_threshold_expression     F^2^>3.0\s(F^2^)
_cod_data_source_file            b101546j.txt
_cod_data_source_block           '[RuBr2(NO)(terpy)]PF6'
_cod_original_formula_sum        'C15 H11 Br2 F6 N4 O P Ru '
_cod_database_code               7010644