Crystallography Open Database

Information card for entry 7200745

7200744 << 7200745 >> 7200746

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Coordinates	7200745.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H7 Cl2 Li O5
Calculated formula	C8 H7 Cl2 Li O5
Title of publication	π-Stacking of quinoid rings in crystals of alkali diaqua hydrogen chloranilates
Authors of publication	Molčanov, Krešimir; Kojić-Prodić, Biserka; Meden, Anton
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	7
Pages of publication	1407
a	13.72 ± 0.02 Å
b	4.975 ± 0.002 Å
c	14.7 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	1003.4 ± 1.7 Å³
Cell temperature	293 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for all reflections included in the refinement	0.1336
Goodness-of-fit parameter for all reflections included in the refinement	1.078
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180338 (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 7/20/07.	7200745.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7200745.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7200745.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7200745.cif