Variable temperature and pressure study of the aquation reactions of cobalt(III) and chromium(III) penta- and tetra-amines †
Benzo, Fabián; Bernhardt, Paul V.; González, Gabriel; Martinez, Manuel; Sienra, Beatriz; Journal of the Chemical Society, Dalton Transactions  (1999) 3973–; doi:10.1039/a907895i

data_7027819
_publ_section_title
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 Variable temperature and pressure study of the aquation reactions of
 cobalt(III) and chromium(III) penta- and tetra-amines&#x200A;&#x2020;
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_journal_issue                   22
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              3973
_journal_paper_doi               10.1039/a907895i
_journal_year                    1999
_chemical_formula_sum            'C12 H29 Cl3 Co N5 O4'
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 ? 
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_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
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_diffrn_measurement_method       'omega-2theta scans'
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_refine_diff_density_max         0.959
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'w=1/[\s^2^(Fo^2^)+(0.0933P)^2^+2.0850P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.1310
_refine_ls_wR_factor_obs         0.1254
_reflns_number_observed          1677
_reflns_number_total             1860
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_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' tag value 'monoclnic' was replaced with
'monoclinic' value as specified in the replacement file
'/home/robertas/cod-tools/perl-scripts/inputs/replacement_values.lst'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0933P)^2^+2.0850P] where P=(Fo^2^+2Fc^2^)/3' 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^(Fo^2^)+(0.0933P)^2^+2.0850P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
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_cod_original_sg_symbol_H-M      'C 2'
_cod_database_code               7027819