Molecular rods based on a ruthenium(ii) macrocyclic bis(acetylide) building block
Choi, Mei-Yuk; Chan, Michael C. W.; Cheung, Kung-Kai; Che, Chi-Ming; Peng, Shie-Ming; Chemical Communications  (2000) 1259–; doi:10.1039/b002674n

data_7110961
_publ_section_title
;
 Molecular rods based on a ruthenium(ii) macrocyclic bis(acetylide)
 building block
;
_journal_issue                   14
_journal_name_full               'Chemical Communications'
_journal_page_first              1259
_journal_paper_doi               10.1039/b002674n
_journal_year                    2000
_chemical_formula_moiety         'C30 H44 N6 Ru'
_chemical_formula_sum            'C30 H44 N6 Ru'
_chemical_formula_weight         589.79
_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'
_audit_creation_date             'Wed Jul  8 18:14:19 1998'
_audit_creation_method           'from TEXRAY.INF file'
_cell_angle_alpha                90
_cell_angle_beta                 97.31(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.763(2)
_cell_length_b                   10.534(2)
_cell_length_c                   15.243(2)
_cell_measurement_reflns_used    0
_cell_measurement_temperature    301.2
_cell_measurement_theta_max      0.0
_cell_measurement_theta_min      0.0
_cell_volume                     1395.6(5)
_computing_cell_refinement       'MAR Data Collection Software & DENZO'
_computing_data_collection       'MAR Data collection Software & DENZO'
_computing_data_reduction        teXsan
_computing_publication_material  teXsan
_computing_structure_refinement  teXsan
_computing_structure_solution    SIR92
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_diffrn_orient_matrix_UB_12      0.00000
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_diffrn_orient_matrix_UB_32      0.00000
_diffrn_orient_matrix_UB_33      0.00000
_diffrn_radiation_detector       'Image Plate Detector'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_type           MoKalpha
_diffrn_radiation_wavelength     0.7107
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_diffrn_standards_decay_%        0.00
_diffrn_standards_interval_count 0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.592
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.403
_exptl_crystal_density_meas      0.000
_exptl_crystal_description       prism
_exptl_crystal_F_000             620.00
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.150
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_refine_ls_extinction_coef       0.00000
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_refine_ls_number_restraints     0
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_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_obs         0.0776
_reflns_number_observed          1532
_reflns_number_total             2741
_reflns_observed_criterion       3.00
_cod_data_source_file            b002674nsup1.cif
_cod_data_source_block           ip323
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7110961