Crystallography Open Database

Information card for entry 1504435

Preview

Coordinates	1504435.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H17 N O4
Calculated formula	C10 H17 N O4
SMILES	O1C(OCC(NC(=O)C(=C)C)C1)OCC
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	23.3691 ± 0.0009 Å
b	5.6401 ± 0.0002 Å
c	19.1585 ± 0.0006 Å
α	90°
β	107.032 ± 0.0011°
γ	90°
Cell volume	2414.41 ± 0.15 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	0.172
Residual factor for significantly intense reflections	0.0733
Weighted residual factors for significantly intense reflections	0.204
Weighted residual factors for all reflections included in the refinement	0.2499
Goodness-of-fit parameter for all reflections included in the refinement	0.96
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	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.	1504435.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1504435.cif
42049	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 1504435 via cif-deposit CGI script.	1504435.cif