[MoH~4~(dppe)~2~].thf (dppe = Ph~2~PCH~2~CH~2~PPh~2~; thf = Tetrahydrofuran)
Pombeiro, A.J.L.; Hills, A.; Hughes, D.L.; Richards, R.L.; Acta Crystallographica Section C 51 (1995) 23–26; doi:10.1107/S0108270194007559

data_2010393
_publ_section_title
;
 [MoH~4~(dppe)~2~].thf (dppe = Ph~2~PCH~2~CH~2~PPh~2~; thf =
 Tetrahydrofuran)
;
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              23
_journal_page_last               26
_journal_paper_doi               10.1107/S0108270194007559
_journal_volume                  51
_journal_year                    1995
_chemical_formula_moiety         'C52 H52 Mo P , C4 H8 O'
_chemical_formula_sum            'C56 H60 Mo O P4'
_chemical_formula_weight         968.9
_space_group_IT_number           13
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yac'
_symmetry_space_group_name_H-M   'P 1 2/n 1'
_atom_type_scat_source           IntTabIV
_cell_angle_alpha                90.
_cell_angle_beta                 104.638(7)
_cell_angle_gamma                90.
_cell_formula_units_Z            2
_cell_length_a                   15.7430(10)
_cell_length_b                   10.3000(10)
_cell_length_c                   15.8300(10)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293
_cell_measurement_theta_max      11
_cell_measurement_theta_min      10
_cell_volume                     2483.6(3)
_diffrn_measurement_device       'Enraf-Nonius CAD-4'
_diffrn_measurement_method       \w-\q
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.005
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            4573
_diffrn_reflns_theta_max         25
_diffrn_standards_decay_%        'steady decrease to 86.3% of starting values'
_diffrn_standards_interval_time  167
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    0.42
_exptl_absorpt_correction_T_max  1.00
_exptl_absorpt_correction_T_min  0.99
_exptl_absorpt_correction_type   empirical
_exptl_crystal_colour            brown-yellow
_exptl_crystal_density_diffrn    1.295
_exptl_crystal_description       'rectangular prisms'
_exptl_crystal_size_max          0.55
_exptl_crystal_size_mid          0.45
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.35
_refine_diff_density_min         -0.29
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_obs   2.13
_refine_ls_number_parameters     330
_refine_ls_number_reflns         4373
_refine_ls_R_factor_obs          0.032
_refine_ls_shift/esd_max         '1.33 (in disordered solvent atoms)'
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/\s^2^(F)'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.040
_reflns_number_observed          3882
_reflns_number_total             4373
_reflns_observed_criterion       I>2\s(I)
_cod_data_source_file            mu1119.cif
_cod_data_source_block           mu1119_structure_1_of_1
_cod_depositor_comments
;
The following automatic conversions were performed:

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

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        2483.5
_cod_original_sg_symbol_H-M      'P 2/n'
_cod_database_code               2010393