Modulation of properties in analogues of Zeise's anion on changing the ligand trans to ethene. X-Ray crystal structures of trans-[PtCl(2)(OH)(η(2)-C(2)H(4))](-) and trans-[PtCl(2)(η(1)-CH(2)NO(2))(η(2)-C(2)H(4))](-).
Benedetti, Michele; Barone, Carmen R.; Antonucci, Daniela; Vecchio, Vita M.; Ienco, Andrea; Maresca, Luciana; Natile, Giovanni; Fanizzi, Francesco P.; Dalton transactions (Cambridge, England : 2003) 41 (2012) 3014–3021; doi:10.1039/c2dt11934j

data_7018201
_publ_section_title
;
 Modulation of properties in analogues of Zeise's anion on changing the
 ligand trans to ethene. X-Ray crystal structures of
 trans-[PtCl(2)(OH)(\h(2)-C(2)H(4))](-) and
 trans-[PtCl(2)(\h(1)-CH(2)NO(2))(\h(2)-C(2)H(4))](-).
;
_journal_issue                   10
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              3014
_journal_page_last               3021
_journal_paper_doi               10.1039/c2dt11934j
_journal_volume                  41
_journal_year                    2012
_chemical_compound_source        'synthesis as described'
_chemical_formula_moiety         'C24 H20 P, C2 H5 Cl2 O Pt'
_chemical_formula_sum            'C26 H25 Cl2 O P Pt'
_chemical_formula_weight         650.42
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_date             2010-12-13T14:58:27-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_cell_angle_alpha                91.152(16)
_cell_angle_beta                 90.206(18)
_cell_angle_gamma                100.160(16)
_cell_formula_units_Z            2
_cell_length_a                   7.956(2)
_cell_length_b                   11.887(2)
_cell_length_c                   13.184(2)
_cell_measurement_reflns_used    24
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      9.19
_cell_measurement_theta_min      6.5
_cell_measurement_wavelength     0.71073
_cell_volume                     1227.0(4)
_computing_cell_refinement       'CAD4 Express (Enraf Nonius, 1994)'
_computing_data_collection       'CAD4 Express (Enraf Nonius, 1994)'
_computing_data_reduction        'XCAD4 (Harms & Wocadlo, 1995)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector                 'scintillation LiI'
_diffrn_detector_dtime           1.195
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device       '\k-geometry diffractometer'
_diffrn_measurement_device_type  'Enraf Nonius CAD4'
_diffrn_measurement_method       'non-profiled omega/2theta scans'
_diffrn_orient_matrix_type
;
x-axis points to radiation source
the matrix is specified in reciprocal space
;
_diffrn_orient_matrix_UB_11      0.098675
_diffrn_orient_matrix_UB_12      0.047741
_diffrn_orient_matrix_UB_13      -0.034416
_diffrn_orient_matrix_UB_21      -0.00321
_diffrn_orient_matrix_UB_22      0.063352
_diffrn_orient_matrix_UB_23      0.050631
_diffrn_orient_matrix_UB_31      0.080987
_diffrn_orient_matrix_UB_32      -0.031866
_diffrn_orient_matrix_UB_33      0.044808
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0175
_diffrn_reflns_av_unetI/netI     0.0394
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            3575
_diffrn_reflns_theta_full        22.97
_diffrn_reflns_theta_max         22.97
_diffrn_reflns_theta_min         1.74
_diffrn_source                   'Enraf Nonius FR590'
_diffrn_standards_decay_%        16
_diffrn_standards_interval_time  120
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    6.017
_exptl_absorpt_correction_T_max  0.4047
_exptl_absorpt_correction_T_min  0.2759
_exptl_absorpt_correction_type   psi-scan
_exptl_absorpt_process_details
;
North A.C.T., Phillips D.C. & Mathews F.S. (1968) Acta. Cryst. A24, 351
Number of psi-scan sets used was 5
Theta correction was applied.
Averaged transmission function was used.
No Fourier smoothing was applied.
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.76
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             632
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.225
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.613
_refine_diff_density_min         -2.003
_refine_diff_density_rms         0.16
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.52
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     281
_refine_ls_number_reflns         3400
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.52
_refine_ls_R_factor_all          0.0781
_refine_ls_R_factor_gt           0.059
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0169P)^2^+8.8909P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1287
_refine_ls_wR_factor_ref         0.1335
_reflns_number_gt                2883
_reflns_number_total             3400
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2dt11934j.txt
_cod_data_source_block           c2
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7018201