Crystallography Open Database

Information card for entry 7200853

7200852 << 7200853 >> 7200854

Preview

Coordinates	7200853.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	ciprofloxacin
Formula	C17 H18 F N3 O3
Calculated formula	C17 H18 F N3 O3
SMILES	Fc1cc2c(n(C3CC3)cc(C(=O)[O-])c2=O)cc1N1CC[NH2+]CC1
Title of publication	Crystal structures with a challenge: high-pressure crystallisation of ciprofloxacin sodium salts and their recovery to ambient pressure
Authors of publication	Fabbiani, Francesca P. A.; Dittrich, Birger; Florence, Alastair J.; Gelbrich, Thomas; Hursthouse, Michael B.; Kuhs, Werner F.; Shankland, Norman; Sowa, Heidrun
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	7
Pages of publication	1396
a	7.9606 ± 0.0002 Å
b	8.5798 ± 0.0002 Å
c	10.7739 ± 0.0003 Å
α	87.868 ± 0.003°
β	85.153 ± 0.002°
γ	88.212 ± 0.001°
Cell volume	732.43 ± 0.03 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Method of determination	powder diffraction
Diffraction radiation wavelength	1.54056 Å
Diffraction radiation type	CuKα~1~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180339 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/08.	7200853.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7200853.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7200853.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7200853.cif