Structures of mono-unsaturated triacylglycerols. I. The β~1~ polymorph
van Mechelen, Jan B.; Peschar, Rene.; Schenk, Henk.; Acta Crystallographica Section B 62 (2006) 1121–1130; doi:10.1107/S0108768106037074

data_2100693
_publ_contact_author_address
;
 Universiteit van Amsterdam
 Van 't Hoff Institute for Molecular Sciences (HIMS)
 Faculty of Science (FNWI)
 Valckenierstraat 65
 1018 XE Amsterdam
 The Netherlands
;
_publ_contact_author_email       janvm@science.uva.nl
_publ_contact_author_fax         '+31 20 5256940'
_publ_contact_author_name        'Jan B. van Mechelen'
_publ_contact_author_phone       '+31 20 5257041'
_publ_section_title
;
 Structures of mono-unsaturated triacylglycerols. I. The \b~1~
 polymorph
;
_publ_section_title_footnote     ' ?'
_journal_coeditor_code           DR5011
_journal_date_accepted           2006-09-12
_journal_date_recd_electronic    2006-07-14
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              1121
_journal_page_last               1130
_journal_paper_category          FA
_journal_paper_doi               10.1107/S0108768106037074
_journal_volume                  62
_journal_year                    2006
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_chemical_melting_point          311
_chemical_name_common            'SOS-POP beta1'
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'(1,3-distearoyl-2-oleoylglycerol) (1,3-dipalmitoyl-2-oleoylglycerol)'
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_symmetry_cell_setting           monoclinic
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_cell_formula_units_Z            4
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_cell_length_b                   125.970(6)
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_cell_measurement_temperature    295
_cell_volume                     5633.7(3)
_computing_structure_refinement  GSAS
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_diffrn_radiation_wavelength     0.79889
_exptl_crystal_density_diffrn    1.020
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_refine_ls_matrix_type           full
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_refine_ls_shift/su_max          0.26
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_cod_data_source_file            dr5011.cif
_cod_data_source_block           SOS-POP-B1-ENAN_publ
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
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'_geom_angle_publ_flag' value 'N' changed to 'n' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
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Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_geom_bond_publ_flag' value 'N' changed to 'n' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (340
times).

'_geom_angle_publ_flag' value 'N' changed to 'n' according
to /home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary
named 'cif_core.dic' version 2.4.1 from 2010-06-29 (330 times).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      'P 21/n'
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