Crystallography Open Database

Information card for entry 4507759

Preview

Coordinates	4507759.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H72 Cd4 N12 O30
Calculated formula	C60 H72 Cd4 N12 O30
Title of publication	Control of Self-Penetration and Dimensionality in Luminescent Cadmium Succinate Coordination Polymers via Isomeric Dipyridylamide Ligands
Authors of publication	Uebler, Jacob W.; Pochodylo, Amy L.; Staples, Richard J.; LaDuca, Robert L.
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	5
Pages of publication	2220
a	13.707 ± 0.0014 Å
b	22.724 ± 0.002 Å
c	21.771 ± 0.002 Å
α	90°
β	91.322 ± 0.001°
γ	90°
Cell volume	6779.4 ± 1.1 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	0.0507
Residual factor for significantly intense reflections	0.03
Weighted residual factors for significantly intense reflections	0.0711
Weighted residual factors for all reflections included in the refinement	0.0809
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
179613 (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 4/50/77.	4507759.cif
85670	2013-05-07	cif/ Adding structures of 4507759 via cif-deposit CGI script.	4507759.cif