Crystallography Open Database

Information card for entry 7216385

Preview

Coordinates	7216385.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H33 Cd N5 O8
Calculated formula	C31 H33 Cd N5 O8
Title of publication	Syntheses, structures and luminescent properties of six divalent metal terephthalate coordination polymers based on three new flexible bis(imidazole) ligands
Authors of publication	Yuan, Wei-Guan; Xiong, Fang; Zhang, Hong-Ling; Tang, Wei; Zhang, Shu-Fang; He, Zhan; Jing, Lin-Hai; Qin, Da-Bin
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	33
Pages of publication	7701
a	16.982 ± 0.004 Å
b	10.725 ± 0.002 Å
c	22.521 ± 0.004 Å
α	90°
β	128.552 ± 0.011°
γ	90°
Cell volume	3207.8 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0465
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.0779
Weighted residual factors for all reflections included in the refinement	0.0849
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
180494 (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 7/21/63.	7216385.cif
121613	2014-08-08	cif/ Updating files of 7216382, 7216383, 7216384, 7216385, 7216386, 7216387 Original log message: Adding full bibliography for 7216382--7216387.cif.	7216385.cif
115619	2014-06-05	cif/ Adding structures of 7216382, 7216383, 7216384, 7216385, 7216386, 7216387 via cif-deposit CGI script.	7216385.cif