Crystallography Open Database

Information card for entry 4509400

Preview

Coordinates	4509400.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H54 Cd2 N6 O12
Calculated formula	C36 H50 Cd2 N6 O12
Title of publication	Structural Diversity in Luminescent Three-Dimensional Cadmium Aliphatic Dicarboxylate Coordination Polymers Incorporating 4,4′-Dipyridylamine: Interpenetrated, Non-Interpenetrated, and Self-Penetrated Networks
Authors of publication	Shyu, Eric; Supkowski, Ronald M.; LaDuca, Robert L.
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	5
Pages of publication	2481
a	10.2938 ± 0.0016 Å
b	10.5884 ± 0.0016 Å
c	18.556 ± 0.003 Å
α	90.444 ± 0.002°
β	95.115 ± 0.002°
γ	93.133 ± 0.002°
Cell volume	2011.3 ± 0.5 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 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	0.0323
Residual factor for significantly intense reflections	0.0245
Weighted residual factors for significantly intense reflections	0.0591
Weighted residual factors for all reflections included in the refinement	0.063
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
179630 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/94.	4509400.cif
97264	2014-01-29	cif/ Adding structures of 4509400 via cif-deposit CGI script.	4509400.cif