Crystallography Open Database

Information card for entry 4110964

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Structure parameters

Formula	Cl4 Cu Ga
Calculated formula	Cl4 Cu Ga
Title of publication	Sorptive Reconstruction of CuMCl4 (M = Al and Ga) upon Small-Molecule Binding and the Competitive Binding of CO and Ethylene
Authors of publication	Michael D. Capracotta; Roger M. Sullivan; James D. Martin
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	13463 - 13473
a	5.4119 ± 0.0004 Å
b	5.4119 Å
c	10.2007 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	298.76 ± 0.05 Å³
Cell temperature	288 K
Ambient diffraction temperature	288 K
Number of distinct elements	3
Space group number	112
Hermann-Mauguin space group symbol	P -4 2 c
Hall space group symbol	P -4 2c
RFsqd	0.39704
Goodness-of-fit parameter for all reflections	30.81
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.92137 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181929 (current)	2016-04-07	hkl/4/ (antanas@echidna.ibt.lt) Adding svn headers to multiple entries in subrange 4/11.	4110964.cif 4110964.hkl
180708	2016-04-02	hkl/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4110964.cif 4110964.hkl
178880	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/09.	4110964.cif 4110964.hkl
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4110964.cif 4110964.hkl
60162	2012-06-14	cif/ hkl/ Adding structures of 4110964 via cif-deposit CGI script.	4110964.cif 4110964.hkl