Hybrid ligands. Structure of a palladium(II) complex containing a pyrazolol-derived phosphine ligand, [(<i>o</i>-C~6~H~4~CH~2~NMe~2~)Pd(Ph~2~P{ṟidge{Cḅ C(O)N(Ph)Nḅ C}{33mm}(Me)})]
Matt, D.; Guillemin, J.-C.; Ziessel, R.; Balegroune, F.; Grandjean, D.; Acta Crystallographica Section C 50 (1994) 193–195; doi:10.1107/S010827019300664X

data_2009466
_publ_section_title
;
 Hybrid ligands. Structure of a palladium(II) complex containing a
 pyrazolol-derived phosphine ligand,
 [(<i>o</i>-C~6~H~4~CH~2~NMe~2~)Pd(Ph~2~P{r&#x0331;idge{Cb&#x0323;
 C(O)N(Ph)Nb&#x0323; C}{33mm}(Me)})]
;
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              193
_journal_page_last               195
_journal_paper_doi               10.1107/S010827019300664X
_journal_volume                  50
_journal_year                    1994
_chemical_formula_sum            'C34 H33 N3 O P Pd'
_chemical_formula_weight         637.03
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_type_scat_source           IntTabIV
_cell_angle_alpha                90.0
_cell_angle_beta                 112.39(4)
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   12.148(12)
_cell_length_b                   18.360(7)
_cell_length_c                   14.815(4)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    294
_cell_measurement_theta_max      12
_cell_measurement_theta_min      9
_cell_volume                     3055(3)
_diffrn_measurement_device       'Enraf-Nonius CAD-4'
_diffrn_measurement_method       '\w/2\q (t~max~ = 60 s)'
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.018
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            5843
_diffrn_reflns_theta_max         25
_diffrn_standards_decay_%        1.4
_diffrn_standards_interval_time  60
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    0.679
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.385
_exptl_crystal_description       Prism
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.60
_refine_diff_density_min         0.05
_refine_ls_goodness_of_fit_obs   1.16
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     361
_refine_ls_number_reflns         3310
_refine_ls_R_factor_obs          0.033
_refine_ls_shift/esd_max         0.3
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = [\s^2^(I) + (0.04F^2^)^2^]^-1/2^'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.053
_reflns_number_observed          3310
_reflns_number_total             3310
_reflns_observed_criterion       I>3\s(I)
_cod_data_source_file            mu1045.cif
_cod_data_source_block           mu1045_atructure_1_of_1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'w = [\s^2^(I) +
(0.04F^2^)^2^]^-1/2^' was changed to 'calc'. New tag
'_refine_ls_weighting_details' was created. The value of the new tag
was set to 'w = [\s^2^(I) + (0.04F^2^)^2^]^-1/2^'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        3055(2)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               2009466