Coupling of platinated triguanides with platinum-activated nitriles as a novel strategy for generation of dimetallic systems.
Serebryanskaya, Tatiyana V.; Novikov, Alexander S.; Gushchin, Pavel V.; Zolotarev, Andrey A.; Gurzhiy, Vladislav V.; Kukushkin, Vadim Yu; Dalton transactions (Cambridge, England : 2003) 44 (2015) 6003–6011; doi:10.1039/c4dt03870c

data_7033999
_publ_section_title
;
 Coupling of platinated triguanides with platinum-activated nitriles as a
 novel strategy for generation of dimetallic systems.
;
_journal_issue                   13
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6003
_journal_page_last               6011
_journal_paper_doi               10.1039/c4dt03870c
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety         'C25 H35 Cl6 N9 Pt2, 2(C H Cl3)'
_chemical_formula_sum            'C27 H37 Cl12 N9 Pt2'
_chemical_formula_weight         1303.24
_chemical_name_systematic
;
 ? 
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_audit_creation_date             2014-12-16
_audit_creation_method
;
Olex2 1.2
(compiled 2014.06.23 svn.r2946 for OlexSys, GUI svn.r4855)
;
_audit_update_record
;
2014-12-16 deposited with the CCDC.
2015-02-11 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 98.307(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.0973(5)
_cell_length_b                   13.5538(5)
_cell_length_c                   26.8946(19)
_cell_measurement_reflns_used    5662
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      24.8200
_cell_measurement_theta_min      3.0300
_cell_volume                     4363.5(4)
_computing_cell_refinement
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_data_collection
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_data_reduction
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_molecular_graphics
;
O. V. Dolomanov, L. J. Bourhis, R. J. Gildea, J. A. K. Howard and H. Puschmann,
OLEX2: a complete structure solution, refinement and analysis program.
J. Appl. Cryst. (2009). 42, 339-341.
;
_computing_publication_material
;
O. V. Dolomanov, L. J. Bourhis, R. J. Gildea, J. A. K. Howard and H. Puschmann,
OLEX2: a complete structure solution, refinement and analysis program.
J. Appl. Cryst. (2009). 42, 339-341.
;
_computing_structure_refinement
;
SHELXL, G.M. Sheldrick, Acta Cryst.
(2008). A64, 112-122
;
_computing_structure_solution    'J. Appl. Cryst. (2007) 40, 786-790'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 16.2096
_diffrn_measured_fraction_theta_full 0.9983
_diffrn_measured_fraction_theta_max 0.9983
_diffrn_measurement_details
;
  1 omega  -27.00   21.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777   57.0000  -30.0000 48

  2 omega   -4.00   22.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777  -99.0000 -120.0000 26

  3 omega  -84.00   -6.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777  -57.0000    0.0000 78

  4 omega   39.00   78.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -       18.8152  178.0000  -30.0000 39

  5 omega  -48.00   35.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -       18.8152  -38.0000   30.0000 83

  6 omega  -90.00  -28.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777  -38.0000   30.0000 62

  7 omega  -31.00   42.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777   57.0000   30.0000 73

  8 omega   -6.00   24.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777  -99.0000  -90.0000 30

  9 omega  -25.00    0.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -      -17.8777  -99.0000  150.0000 25

 10 omega   15.00   41.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -       18.8152   57.0000   60.0000 26

 11 omega   53.00   78.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -       18.8152   57.0000   60.0000 25

 12 omega   41.00   67.00   1.0000  160.0000
omega____ theta____ kappa____ phi______ frames
    -       18.8152  178.0000   30.0000 26
;
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       '\w scans'
_diffrn_orient_matrix_UB_11      -0.0118465000
_diffrn_orient_matrix_UB_12      -0.0512177000
_diffrn_orient_matrix_UB_13      -0.0015873000
_diffrn_orient_matrix_UB_21      0.0342831000
_diffrn_orient_matrix_UB_22      -0.0074626000
_diffrn_orient_matrix_UB_23      0.0234218000
_diffrn_orient_matrix_UB_31      -0.0468521000
_diffrn_orient_matrix_UB_32      0.0074706000
_diffrn_orient_matrix_UB_33      0.0126636000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0839
_diffrn_reflns_av_unetI/netI     0.0988
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_number            42248
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         2.60
_diffrn_source                   'Enhance (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    7.173
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.88202
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_density_diffrn    1.984
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2488
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.19
_exptl_crystal_size_min          0.16
_refine_diff_density_max         5.103
_refine_diff_density_min         -3.248
_refine_diff_density_rms         0.269
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.043
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         8537
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.043
_refine_ls_R_factor_all          0.1433
_refine_ls_R_factor_gt           0.0945
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0705P)^2^+149.6266P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1998
_refine_ls_wR_factor_ref         0.2329
_reflns_number_gt                5610
_reflns_number_total             8537
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4dt03870c2.cif
_cod_data_source_block           stv_1807
_cod_depositor_comments
'Adding full bibliography for 7033998--7033999.cif.'
_cod_database_code               7033999
_chemical_oxdiff_formula         'C20 H30 Pt Cl N10'
_reflns_odcompleteness_completeness 99.83
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_olex2_submission_special_instructions 'No special instructions were received'