Synthesis, Structure and Antitumour Properties of a New 1,2-Propilenediaminetetraacetate-Ruthenium(III) Compound
Rosario Vilaplana; M. Angustias Romero; Miguel Quirós; Juan M. Salas; Francisco González-Vílchez; Metal Based Drugs 2 (1995) 211–219; doi:10.1155/MBD.1995.211

data_1511766
_publ_section_title
;
 Synthesis, Structure and Antitumour Properties of a New
 1,2-Propilenediaminetetraacetate-Ruthenium(III) Compound
;
_journal_name_full               'Metal Based Drugs'
_journal_page_first              211
_journal_page_last               219
_journal_paper_doi               10.1155/MBD.1995.211
_journal_volume                  2
_journal_year                    1995
_chemical_formula_sum            'C11 H24 Cl2 N2 O12 Ru'
_chemical_formula_weight         548.3
_space_group_IT_number           33
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     heavy
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.571(3)
_cell_length_b                   7.464(1)
_cell_length_c                   14.617(3)
_cell_measurement_temperature    292(2)
_cell_volume                     2026.1(6)
_diffrn_measurement_device_type  'Stoe Siemens AED 2'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            6741
_diffrn_reflns_theta_max         30.00
_exptl_absorpt_coefficient_mu    1.099
_exptl_absorpt_correction_T_max  0.781
_exptl_absorpt_correction_T_min  0.623
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.797
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             1112
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.91
_refine_diff_density_min         -1.39
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.02
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_reflns         4947
_refine_ls_R_factor_all          0.044
_refine_ls_R_factor_gt           0.033
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'calc w=1/[\s^2^(Fo^2^)+0.001(Fo^2^)]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.033
_reflns_number_gt                4947
_reflns_number_total             5988
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ruse.cif
_cod_data_source_block           ruse
_cod_original_cell_volume        2026.2(8)
_cod_original_formula_sum        'C11 H24 Cl2 Ru N2 O12'
_cod_database_code               1511766