Crystallography Open Database

Information card for entry 7215131

Preview

Coordinates	7215131.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H27 F N3 O9
Calculated formula	C28 H27 F N3 O9
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	9.8768 ± 0.0019 Å
b	10.2489 ± 0.0019 Å
c	13.674 ± 0.003 Å
α	89.319 ± 0.004°
β	74.752 ± 0.004°
γ	71.679 ± 0.004°
Cell volume	1264 ± 0.4 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0801
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1782
Weighted residual factors for all reflections included in the refinement	0.23
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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.	7215131.cif
111339	2014-04-21	cif/ Adding structures of 7215129, 7215130, 7215131, 7215132, 7215133 via cif-deposit CGI script.	7215131.cif