Selective ethylene oligomerisation using supported tungsten mono-imido catalysts
Wright, Christopher M. R.; Williams, Thomas J.; Turner, Zoë R.; Buffet, Jean-Charles; O'Hare, Dermot; Inorganic Chemistry Frontiers 4 (2017) 1048–; doi:10.1039/C7QI00128B

data_4349694
_publ_section_title
;
 Selective ethylene oligomerisation using supported tungsten mono-imido
 catalysts
;
_journal_issue                   6
_journal_name_full               'Inorganic Chemistry Frontiers'
_journal_page_first              1048
_journal_paper_doi               10.1039/C7QI00128B
_journal_volume                  4
_journal_year                    2017
_chemical_formula_moiety         'C11 H15 Cl4 N O2 W'
_chemical_formula_sum            'C11 H15 Cl4 N O2 W'
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_chemical_properties_physical    ', Air-sensitive,Moisture-sensitive'
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_audit_update_record
;
2016-11-23 deposited with the CCDC.
2017-05-10 downloaded from the CCDC.
;
_cell_angle_alpha                90
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'HKL Denzo and Scalepack (Otwinowski & Minor 1997)'
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_computing_publication_material  'WinGX publication routines (Farrugia, 1999)'
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;
SHELXS-2013 - Sheldrick, G. M. Acta Crystallogr., Sect. A 2008, 64, 112-122.
;
_diffrn_ambient_temperature      150(2)
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;
Multi-scan from symmetry-related measurements using
Sortav (Blessing 1995)
;
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'Re-crystallisation from solvent: pentane'
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0441P)^2^+0.2202P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0719
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_reflns_number_total             3921
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-scan' was
changed to 'multi-scan' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/RSC/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               4349694
_shelx_estimated_absorpt_t_min   0.300
_shelx_estimated_absorpt_t_max   0.504
_shelxl_version_number           2014-3
_shelx_res_checksum              27007