New ruthenium(ii) coordination compounds possessing bidentate aminomethylphosphane ligands: synthesis, characterization and preliminary biological study in vitro.
Płotek, Michał; Starosta, Radosław; Komarnicka, Urszula K.; Skórska-Stania, Agnieszka; Jeżowska-Bojczuk, Małgorzata; Stochel, Grażyna; Kyzioł, Agnieszka; Dalton transactions (Cambridge, England : 2003) 44 (2015) 13969–13978; doi:10.1039/c5dt01119a

data_7035378
_publ_section_title
;
 New ruthenium(ii) coordination compounds possessing bidentate
 aminomethylphosphane ligands: synthesis, characterization and preliminary
 biological study in vitro.
;
_journal_issue                   31
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              13969
_journal_page_last               13978
_journal_paper_doi               10.1039/c5dt01119a
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety         'C42 H56 Cl2 N6 P2 Ru, C H Cl3'
_chemical_formula_sum            'C43 H57 Cl5 N6 P2 Ru'
_chemical_formula_weight         998.233
_chemical_name_systematic
(OC-6-33)-bis(acetonitrile)dichlorobis{{1-[4-ethyl(tetrahydro-1,4-diazino)]methyl}diphenylphosphine-?P}ruthenium(II)
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
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;
2015-05-07 deposited with the CCDC.
2015-06-08 downloaded from the CCDC.
;
_cell_angle_alpha                90
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CrysAlis RED, Oxford Diffraction Ltd.,
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CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.33.66 (release 28-04-2010 CrysAlis171 .NET)
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CrysAlis RED, Oxford Diffraction Ltd.,
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_diffrn_ambient_temperature      293(2)
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;
  1 omega  -74.00   70.75   0.7500   20.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -79.0000    0.0000 193

  2 omega  -74.00   70.75   0.7500   20.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -79.0000   90.0000 193

  3 omega  -74.00   70.75   0.7500   20.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -79.0000  180.0000 193

  4 omega  -74.00   70.75   0.7500   20.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -79.0000  270.0000 193

  5 omega  -54.00   27.75   0.7500   40.0000
omega____ theta____ kappa____ phi______ frames
    -       48.0000  -79.0000   45.0000 109

;
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, Atlas'
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_diffrn_radiation_probe          x-ray
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_diffrn_radiation_wavelength     0.71073
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_diffrn_reflns_number            26561
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.604
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         36.7920
_diffrn_reflns_theta_min         2.8114
_exptl_absorpt_coefficient_mu    0.702
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.88546
_exptl_absorpt_correction_type   multi-scan
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CrysAlis RED, Oxford Diffraction Ltd.,
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Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
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_exptl_crystal_colour            yellow
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_exptl_crystal_description       needles
_exptl_crystal_F_000             1032
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_exptl_crystal_size_mid          0.07
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.877
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_refine_diff_density_rms         0.098
_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
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_refine_ls_number_restraints     0
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_refine_ls_R_factor_all          0.0599
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_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
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;
 w=1/[\s^2^(Fo^2^)+(0.0421P)^2^+2.8496P]
 where P=(Fo^2^+2Fc^2^)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0989
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_reflns_Friedel_coverage         0
_reflns_number_gt                6265
_reflns_number_total             7510
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c5dt01119a2.cif
_cod_data_source_block           rupp1a
_cod_depositor_comments
'Adding full bibliography for 7035374--7035378.cif.'
_cod_original_sg_symbol_H-M      'P 21/m'
_cod_database_code               7035378