Structure of (<i>S</i>)-(+)-ibuprofen
Freer, A. A.; Bunyan, J. M.; Shankland, N.; Sheen, D. B.; Acta Crystallographica Section C 49 (1993) 1378–1380; doi:10.1107/S0108270193000629

data_2001546
_publ_section_title
;
 Structure of (<i>S</i>)-(+)-ibuprofen
;
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1378
_journal_page_last               1380
_journal_paper_doi               10.1107/S0108270193000629
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'C13 H18 O2'
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_cell_length_c                   13.539(4)
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_cell_measurement_theta_max      15
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_cell_volume                     1248.9(7)
_diffrn_measurement_device       CAD-4
_diffrn_measurement_method       \w/2\q
_diffrn_radiation_type           MoK\a
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_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/\s^2^(F~o~)'
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_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value '1/\s^2^(F~o~)' 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^(F~o~)'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
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_cod_original_cell_volume        1248.8
_cod_database_code               2001546