Crystallography Open Database

Information card for entry 4512710

Preview

Coordinates	4512710.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H42 Cd3 N5 O14
Calculated formula	C52 H42 Cd3 N5 O14
Title of publication	Syntheses, Characterizations, Luminescent Properties, and Controlling Interpenetration of Five Metal‒Organic Frameworks Based on Bis(4-(pyridine-4-yl)phenyl)amine
Authors of publication	Wang, Zhong-Jie; Qin, Ling; Zhang, Xin; Chen, Jin-Xi; Zheng, He-Gen
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	3
Pages of publication	1303
a	11.7865 ± 0.0019 Å
b	16.716 ± 0.003 Å
c	52.892 ± 0.008 Å
α	90°
β	90°
γ	90°
Cell volume	10421 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.078
Residual factor for significantly intense reflections	0.0689
Weighted residual factors for significantly intense reflections	0.1505
Weighted residual factors for all reflections included in the refinement	0.1549
Goodness-of-fit parameter for all reflections included in the refinement	1.046
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
179675 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/27.	4512710.cif
134750	2015-04-04	cif/ Updating files of 4512709, 4512710, 4512711, 4512712, 4512713 Original log message: Adding full bibliography for 4512709--4512713.cif.	4512710.cif
131785	2015-02-13	cif/ Adding structures of 4512709, 4512710, 4512711, 4512712, 4512713 via cif-deposit CGI script.	4512710.cif