Crystallography Open Database

Information card for entry 1517719

Preview

Coordinates	1517719.cif

Structure parameters

Formula	C27 H19.5 Cd2 N3 O10.25
Calculated formula	C27 H19 Cd2 N3 O10.125
Title of publication	Dipyridylamide isomer influenced dimensionality in luminescent cadmium phthalate coordination polymers with similar tetranuclear clusters and ribbon motifs
Authors of publication	Julie A. Wilson; Peter E. Kraft; Robert L. LaDuca
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	404
Pages of publication	97 - 104
a	7.4378 ± 0.0005 Å
b	20.871 ± 0.0014 Å
c	33.529 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	5204.9 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0383
Residual factor for significantly intense reflections	0.0286
Weighted residual factors for significantly intense reflections	0.0625
Weighted residual factors for all reflections included in the refinement	0.0667
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
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.	1517719.cif
123775	2014-09-12	cif/ Adding structures of 1517719 via cif-deposit CGI script.	1517719.cif