Inter- and Intramolecular π-Stacking Interactions in cis-Bis{1-(9-anthracene)}phosphirane Complexes of Platinum(II)
Fan Yang; Philip E. Fanwick; Clifford P. Kubiak; Inorganic Chemistry 41 (2002) 4805–4809; doi:10.1021/ic020061t

data_4318500
_publ_contact_author_address
;    Department of Chemistry
      Purdue University
      W. Lafayette
      IN 47907
      USA
;
_publ_contact_author_email       fanwick@.xray.chem.purdue.edu
_publ_contact_author_fax         1(765)4940239
_publ_contact_author_name        'Fanwick, Phillip E.'
_publ_contact_author_phone       1(765)4944572
_publ_section_title
;
 Inter- and Intramolecular \p-Stacking Interactions in
 cis-Bis{1-(9-anthracene)}phosphirane Complexes of Platinum(II)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4805
_journal_page_last               4809
_journal_paper_doi               10.1021/ic020061t
_journal_volume                  41
_journal_year                    2002
_chemical_formula_sum            'C36 H26 N2 P2 Pt S2'
_chemical_formula_weight         807.79
_chemical_name_systematic        ' ?'
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_symmetry_cell_setting           triclinic
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_symmetry_space_group_name_H-M   'P -1'
_atom_type_scat_source           International_Tables_for_Xray_Crystallography
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_cell_angle_beta                 85.728(13)
_cell_angle_gamma                77.769(13)
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_cell_length_b                   12.6638(16)
_cell_length_c                   14.8719(19)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    296
_cell_measurement_theta_max      25
_cell_measurement_theta_min      18
_cell_volume                     1579.1(4)
_computing_cell_refinement       CAD4_(Enraf-Nonius,_1977)
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_computing_data_reduction        PROCESS_MolEN_(Fair,_1990)
_computing_molecular_graphics    ORTEP_(Johnson,_1976)
_computing_publication_material  CIF_VAX_MolEN_(Fair,_1990)
_computing_structure_refinement  LSFM_MolEN_(Fair,_1990)
_computing_structure_solution    Direct_methods_(Shelxs86,_Sheldrick,_1985)
_diffrn_ambient_temperature      296
_diffrn_measurement_device_type  Enraf_Nonius_CAD4
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_diffrn_reflns_limit_k_min       -15
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_diffrn_reflns_limit_l_min       -18
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_diffrn_reflns_theta_min         2.72
_diffrn_standards_decay_%        2.26
_diffrn_standards_interval_time  83
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_exptl_absorpt_correction_T_min  0.0987
_exptl_absorpt_correction_type   refdelf_(Walker_&_Stuart,_1983)
_exptl_crystal_colour            yellow
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_refine_ls_weighting_details     '4Fo^2^/ (\s^2^(Fo^2^) + 0.0016 Fo^4^)'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                5362
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_cod_data_source_file            ic020061t_2.cif
_cod_data_source_block           PTANDC
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc ' changed to 'calc'
according to the built-in table from CIF Core dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_cell_volume        1579.1(5)
_cod_original_formula_sum        'C36 H26 N2 P2 Pt1 S2'
_cod_database_code               4318500