Crystallography Open Database

Information card for entry 7230481

Preview

Coordinates	7230481.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Zonisamide-2-hydroxy-5-methylpyridine
Formula	C14 H15 N3 O4 S
Calculated formula	C14 H15 N3 O4 S
Title of publication	Cocrystals of zonisamide: physicochemical characterization and sustained release solid forms
Authors of publication	Aitipamula, Srinivasulu; Cadden, Joseph; Chow, Pui Shan
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	21
Pages of publication	2923
a	14.1373 ± 0.0003 Å
b	11.23707 ± 0.00018 Å
c	9.45521 ± 0.00017 Å
α	90°
β	106.276 ± 0.0019°
γ	90°
Cell volume	1441.87 ± 0.05 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	5
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	0.0324
Residual factor for significantly intense reflections	0.0301
Weighted residual factors for significantly intense reflections	0.0775
Weighted residual factors for all reflections included in the refinement	0.079
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation probe	x-ray
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
229111 (current)	2019-11-17	cif/ Updating files of 7230481, 7230482 Original log message: Adding full bibliography for 7230481--7230482.cif.	7230481.cif
207372	2018-04-17	cif/ Adding structures of 7230481, 7230482 via cif-deposit CGI script.	7230481.cif