Crystallography Open Database

Information card for entry 7001128

Preview

Coordinates	7001128.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H16 Cu N4 O3
Calculated formula	C10 H16 Cu N4 O3
Title of publication	Alcoholysis/hydrolysis of 1,1′-carbonyldiimidazole as a means of preparing unprecedented, imidazole-containing one-dimensional coordination polymers of copper(II)
Authors of publication	Stamatatos, Theocharis C.; Perlepes, Spyros P.; Raptopoulou, Catherine P.; Terzis, Aris; Patrickios, Costas S.; Tasiopoulos, Anastasios J.; Boudalis, Athanassios K.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	17
Pages of publication	3354 - 3362
a	11.686 ± 0.005 Å
b	14.239 ± 0.005 Å
c	8.467 ± 0.003 Å
α	90°
β	108.269 ± 0.016°
γ	90°
Cell volume	1337.9 ± 0.9 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0517
Residual factor for significantly intense reflections	0.0479
Weighted residual factors for significantly intense reflections	0.1364
Weighted residual factors for all reflections included in the refinement	0.1426
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179708 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/11.	7001128.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7001128.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7001128.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7001128.cif