Bis(μ-trifluoroacetato-<i>O</i>,<i>O</i>')bis{[3-chloro-6-methyl-2-(<i>N</i>-methyl-<i>N</i>-nitrosoamino)phenyl-<i>C</i>,<i>N</i>^N=O^]palladium(II)}
Mossi, W.; Klaus, A. J.; Rys, P.; Currao, A.; Nesper, R.; Acta Crystallographica Section C 51 (1995) 2549–2551; doi:10.1107/S0108270195008559

data_2004265
_publ_section_title
Bis(\m-trifluoroacetato-<i>O</i>,<i>O</i>')bis{[3-chloro-6-methyl-2-(<i>N</i>-methyl-<i>N</i>-nitrosoamino)phenyl-<i>C</i>,<i>N</i>^N=O^]palladium(II)}
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              2549
_journal_page_last               2551
_journal_paper_doi               10.1107/S0108270195008559
_journal_volume                  51
_journal_year                    1995
_chemical_formula_moiety         'C20 H16 Cl2 F6 N4 O6 Pd2'
_chemical_formula_sum            'C20 H16 Cl2 F6 N4 O6 Pd2'
_chemical_formula_weight         806.07
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_audit_creation_method           SHELXL
_cell_angle_alpha                90.00
_cell_angle_beta                 138.54(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.194(8)
_cell_length_b                   12.293(4)
_cell_length_c                   18.938(9)
_cell_measurement_reflns_used    '3 still exposures on scanner'
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      26
_cell_measurement_theta_min      4
_cell_volume                     2650(3)
_computing_cell_refinement       'CELL (STOE)'
_computing_data_collection       'EXPOSE (STOE)'
_computing_data_reduction        'CONVERT (STOE)'
_computing_molecular_graphics
'ORTEPII (Johnson, 1976), Larson et al., 1986)'
_computing_publication_material  'SHELXL93 (Sheldrick, 1993)'
_computing_structure_refinement  'SHELXL93 (Sheldrick, 1993)'
_computing_structure_solution    'SHELXS86 (Sheldrick, 1985)'
_diffrn_ambient_temperature      298(2)
_diffrn_measurement_device       'Scanner STOE IPDS'
_diffrn_measurement_method       Oscillation
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0584
_diffrn_reflns_av_sigmaI/netI    0.0558
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            9933
_diffrn_reflns_theta_max         25.99
_diffrn_reflns_theta_min         4.60
_diffrn_standards_number         No
_exptl_absorpt_coefficient_mu    1.645
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'dark red'
_exptl_crystal_density_diffrn    2.020
_exptl_crystal_description       plate
_exptl_crystal_F_000             1568
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.08
_refine_diff_density_max         .501
_refine_diff_density_min         -.622
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.129
_refine_ls_goodness_of_fit_obs   1.129
_refine_ls_hydrogen_treatment    'H atoms placed in calculated positions'
_refine_ls_matrix_type           full
_refine_ls_number_parameters     337
_refine_ls_number_reflns         3100
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.167
_refine_ls_restrained_S_obs      1.127
_refine_ls_R_factor_all          0.1099
_refine_ls_R_factor_obs          0.0593
_refine_ls_shift/esd_max         -0.001
_refine_ls_shift/esd_mean        0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_scheme
;
calc w = 1/[\s^2^(F~o~^2^) + (0.0427P)^2^ + 11.0225P]
where P = (F~o~^2^ + 2F~c~^2^)/3
;
_refine_ls_wR_factor_all         0.1541
_refine_ls_wR_factor_obs         0.1191
_reflns_number_observed          3100
_reflns_number_total             4692
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            jz1060.cif
_cod_data_source_block           waldo
_cod_original_cell_volume        2650.(2)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               2004265