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Information card for entry 1504434
Preview
Coordinates | 1504434.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C10 H17 N O4 |
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Calculated formula | C10 H17 N O4 |
SMILES | O=C(NC1COC(OC1)OCC)C(=C)C |
Title of publication | Stereochemical Effect ofTrans/CisIsomers on the Aqueous Solution Properties of Acid-Labile Thermoresponsive Polymers |
Authors of publication | Huang, Xiaonan; Du, Fusheng; Liang, Dehai; Lin, Shrong-Shi; Li, Zichen |
Journal of publication | Macromolecules |
Year of publication | 2008 |
Journal volume | 41 |
Journal issue | 14 |
Pages of publication | 5433 |
a | 4.9954 ± 0.0001 Å |
b | 13.3694 ± 0.0003 Å |
c | 17.6342 ± 0.0005 Å |
α | 90° |
β | 94.931 ± 0.001° |
γ | 90° |
Cell volume | 1173.35 ± 0.05 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0942 |
Residual factor for significantly intense reflections | 0.0662 |
Weighted residual factors for significantly intense reflections | 0.1856 |
Weighted residual factors for all reflections included in the refinement | 0.2105 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
198633 (current) | 2017-07-11 | cod/ (melanie@ameba.ibt.lt) Correcting the '_refine_ls_hydrogen_treatment' data item 'constr' enumeration values with the help of the cif_fix_values script from the cod-tools package revision 5455. The following command was used : cif_fix_values --fix-misspelled src/cod-tools/trunk/data/replacement-values/replacement_values.lst $i | cif_filter --no-exclude-publication-details -h $i | sponge $i A total of 700 files were changed. |
1504434.cif |
176729 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1504434.cif |
120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1504434.cif |
42048 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 1504434 via cif-deposit CGI script. |
1504434.cif |
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Users of the data should acknowledge the original authors of the
structural data.