Synthesis, Characterization, and Ethylene Polymerization Activities of Neutral Nickel(II) Complexes Derived from Anilino-Substituted Enone Ligands Bearing Trifluoromethyl and Trifluoroacetyl Substituents
Zhang, Lei; Brookhart, Maurice; White, Peter S.; Organometallics 25 (2006) 1868–; doi:10.1021/om050931p

data_4074834
_publ_section_title
;
 Synthesis, Characterization, and Ethylene Polymerization Activities of
 Neutral Nickel(II) Complexes Derived from Anilino-Substituted Enone
 Ligands Bearing Trifluoromethyl and Trifluoroacetyl Substituents
;
_journal_issue                   8
_journal_name_full               Organometallics
_journal_page_first              1868
_journal_paper_doi               10.1021/om050931p
_journal_volume                  25
_journal_year                    2006
_chemical_formula_moiety         'C19 H21 F6 N O2 '
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_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                111.170(3)
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_cell_angle_gamma                97.324(3)
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_cell_length_b                   10.9073(5)
_cell_length_c                   10.9450(5)
_cell_measurement_reflns_used    1020
_cell_measurement_temperature    173
_cell_measurement_theta_max      28.00
_cell_measurement_theta_min      2.50
_cell_volume                     969.28(8)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT/NRCVAX DATRD2'
_computing_molecular_graphics    NRCVAX
_computing_publication_material  'NRCVAX TABLES Jan 94 Version'
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_computing_structure_solution    'NRCVAX SOLVER'
_diffrn_ambient_temperature      173
_diffrn_measurement_device       'Bruker SMART 1K'
_diffrn_measurement_method       'Omega and Phi scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'xray tube'
_diffrn_radiation_type           'Molybdenum K\a'
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_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -14
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_diffrn_reflns_theta_max         27.97
_diffrn_reflns_theta_min         0.00
_exptl_absorpt_coefficient_mu    0.13
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_exptl_absorpt_correction_T_min  1.0000
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            brown
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_exptl_crystal_description       block
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_refine_ls_weighting_scheme      calc
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_reflns_observed_criterion       'Inet > 2.5\s(Inet)'
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_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        969.28(7)
_cod_original_formula_sum        'C19 H21 F6 N O2 '
_cod_database_code               4074834