Crystallography Open Database

Information card for entry 7215133

Preview

Coordinates	7215133.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H64 F2 N8 O21
Calculated formula	C48 H64 F2 N8 O21
Title of publication	Norfloxacin salts with benzenedicarboxylic acids: charge-assisted hydrogen-bonding recognition and solubility regulation
Authors of publication	Huang, Xian-Feng; Zhang, Zhi-Hui; Zhang, Qing-Qing; Wang, Ling-Zhu; He, Ming-Yang; Chen, Qun; Song, Guo-Qiang; Wei, Lin; Wang, Fan; Du, Miao
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	30
Pages of publication	6090
a	9.964 ± 0.003 Å
b	14.76 ± 0.004 Å
c	18.275 ± 0.005 Å
α	90°
β	90.283 ± 0.005°
γ	90°
Cell volume	2687.6 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0952
Residual factor for significantly intense reflections	0.0797
Weighted residual factors for significantly intense reflections	0.2345
Weighted residual factors for all reflections included in the refinement	0.2475
Goodness-of-fit parameter for all reflections included in the refinement	1.039
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
180482 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/51.	7215133.cif
111339	2014-04-21	cif/ Adding structures of 7215129, 7215130, 7215131, 7215132, 7215133 via cif-deposit CGI script.	7215133.cif