Crystallography Open Database

Information card for entry 1517822

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Coordinates	1517822.cif

Structure parameters

Formula	C21 H28 Cu2 N3 O12.5
Calculated formula	C21 H21 Cu2 N3 O12.5
Title of publication	Copper glutarate coordination polymers with dipyridylamide ligands: Effect of donor disposition and steric bulk on structure
Authors of publication	Jacob W. Uebler; Amy L. Pochodylo; Robert L. LaDuca
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	405
Pages of publication	31 - 42
a	8.531 ± 0.002 Å
b	12.57 ± 0.004 Å
c	13.252 ± 0.004 Å
α	105.078 ± 0.003°
β	90.123 ± 0.003°
γ	107.139 ± 0.003°
Cell volume	1306.4 ± 0.7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1878
Residual factor for significantly intense reflections	0.0896
Weighted residual factors for significantly intense reflections	0.2182
Weighted residual factors for all reflections included in the refinement	0.2621
Goodness-of-fit parameter for all reflections included in the refinement	0.989
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1517822.cif
124191	2014-09-24	cif/ Adding structures of 1517822 via cif-deposit CGI script.	1517822.cif