Crystallography Open Database

Information card for entry 2241260

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Structure parameters

Chemical name	μ-Oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis[[4-(2-aminoethyl)-1<i>H</i>-imidazole-κ^2^<i>N</i>^3^,<i>N</i>^4^](dicyanamido-κ<i>N</i>^1^)copper(II)]
Formula	C16 H18 Cu2 N12 O4
Calculated formula	C15.996 H17.988 Cu2 N12 O4
Title of publication	Crystal structures of μ-oxalato-bis[azido(histamine)copper(II)] and μ-oxalato-bis[(dicyanamido)(histamine)copper(II)]
Authors of publication	Liu, Chen; Abboud, Khalil A.
Journal of publication	Acta Crystallographica Section E
Year of publication	2015
Journal volume	71
Journal issue	11
Pages of publication	1379 - 1383
a	9.6816 ± 0.0007 Å
b	14.7236 ± 0.0011 Å
c	7.4604 ± 0.0006 Å
α	90°
β	90.112 ± 0.001°
γ	90°
Cell volume	1063.46 ± 0.14 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0364
Residual factor for significantly intense reflections	0.0338
Weighted residual factors for significantly intense reflections	0.0944
Weighted residual factors for all reflections included in the refinement	0.0956
Goodness-of-fit parameter for all reflections included in the refinement	1.146
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181913 (current)	2016-04-06	hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/12.	2241260.cif 2241260.hkl
169849	2015-10-29	cif/ hkl/ Adding structures of 2241259, 2241260 via cif-deposit CGI script.	2241260.cif 2241260.hkl