Reactivity of Organothorium Complexes with TEMPO.
Langeslay, Ryan R.; Walensky, Justin R.; Ziller, Joseph W.; Evans, William J.; Inorganic chemistry 53 (2014) 8455–8463; doi:10.1021/ic501034b

data_4340560
_publ_section_title
;
 Reactivity of Organothorium Complexes with TEMPO.
;
_journal_issue                   16
_journal_name_full               'Inorganic chemistry'
_journal_page_first              8455
_journal_page_last               8463
_journal_paper_doi               10.1021/ic501034b
_journal_volume                  53
_journal_year                    2014
_chemical_formula_sum            'C18 H36 Br2 N2 O2 Th'
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; 
 ? 
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_computing_cell_refinement       'Bruker SAINT 7.68a, 2009'
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_diffrn_measurement_method       '\f and \w scans'
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_exptl_crystal_colour            colorless
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_exptl_crystal_density_meas      ?
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_refine_ls_R_factor_all          0.0262
_refine_ls_R_factor_gt           0.0206
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0236P)^2^+2.1484P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0464
_refine_ls_wR_factor_ref         0.0481
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4164
_reflns_number_total             4720
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ic501034b_si_002.cif
_cod_data_source_block           rrl1
_cod_depositor_comments
;Adding full bibliography for 4340558--4340566.cif.

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not_measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        2301.9(5)
_cod_database_code               4340560
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_shelx_hkl_checksum              62381