Crystallography Open Database

Information card for entry 7211368

Preview

Coordinates	7211368.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H22 Cd5 N24 O14
Calculated formula	C42 H22 Cd5 N24 O14
Title of publication	Two photoluminescent metal‒organic frameworks with highly-connected topological nets
Authors of publication	Yang, E.; Ding, Qing-Rong; Kang, Yao; Wang, Fei
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	48
Pages of publication	10563
a	12.0876 ± 0.0005 Å
b	13.9694 ± 0.0005 Å
c	17.0235 ± 0.0006 Å
α	91.703 ± 0.003°
β	110.084 ± 0.003°
γ	100.902 ± 0.003°
Cell volume	2637 ± 0.18 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0429
Residual factor for significantly intense reflections	0.0343
Weighted residual factors for significantly intense reflections	0.089
Weighted residual factors for all reflections included in the refinement	0.093
Goodness-of-fit parameter for all reflections included in the refinement	1.194
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
180444 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/13.	7211368.cif
91448	2013-12-13	cif/ Adding structures of 7211367, 7211368 via cif-deposit CGI script.	7211368.cif