Polysulfonylamines. XCI. Ethylammonium Di(benzenesulfonyl)amide 1,4,7,10,13,16-Hexaoxacyclooctadecane (1/1/1)
Henschel, Dagmar; Blaschette, Armand; Jones, Peter G.; Acta Crystallographica Section C 53 (1997) 1875–1877; doi:10.1107/S010827019701007X

data_2006848
_publ_section_title
;
 Polysulfonylamines. XCI. Ethylammonium Di(benzenesulfonyl)amide
 1,4,7,10,13,16-Hexaoxacyclooctadecane (1/1/1)
;
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1875
_journal_page_last               1877
_journal_paper_doi               10.1107/S010827019701007X
_journal_volume                  53
_journal_year                    1997
_chemical_formula_iupac          'C2 H8 N + , C12 H10 N O4 S2 - , C12 H24 O6'
_chemical_formula_moiety
'(C2 H8 N +) , (C12 H10 N O4 S2 -) , C12 H24 O6'
_chemical_formula_sum            'C26 H42 N2 O10 S2'
_chemical_formula_weight         606.74
_chemical_name_systematic
;
 Ethylammonium Di(benzenesulfonyl)amide:
 1,4,7,10,13,16-Hexaoxacyclooctadecane (1:1)
;
_space_group_IT_number           4
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_computing_data_collection       'DIF4 (Stoe & Cie, 1991a)'
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_computing_molecular_graphics    'XP (Siemens, 1994)'
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_diffrn_ambient_temperature      143(2)
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0407P)^2^+0.4511P] where P=(Fo^2^+2Fc^2^)/3'
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_refine_ls_wR_factor_obs         .0756
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_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            ln1011.cif
_cod_data_source_block           create
_cod_depositor_comments
;
The following automatic conversions were performed:

'_geom_angle_publ_flag' value 'Y' changed to 'y' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (13 times).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 

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 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc w =
1/[\s^2^(Fo^2^)+(0.0407P)^2^+0.4511P] 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^)+(0.0407P)^2^+0.4511P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        1488.0(6)
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               2006848