Crystallography Open Database

Information card for entry 7208534

7208533 << 7208534 >> 7208535

Preview

Coordinates	7208534.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49.5 H40.5 N6.5 O12.5 Zn2
Calculated formula	C49.5 H40.5 N6.5 O12.5 Zn2
Title of publication	Carboxylate-assisted acylamide metal‒organic frameworks: synthesis, structure, thermostability and luminescence studies
Authors of publication	Sun, Gong-ming; Huang, Hai-xiao; Tian, Xiao-zhao; Song, Yu-mei; Zhu, Yan; Yuan, Zi-jun; Xu, Wen-yuan; Luo, Ming-biao; Liu, Shu-juan; Feng, Xue-feng; Luo, Feng
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	19
Pages of publication	6182
a	10.9501 ± 0.0004 Å
b	20.6804 ± 0.0009 Å
c	21.8474 ± 0.0009 Å
α	90°
β	94.217 ± 0.002°
γ	90°
Cell volume	4934 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0775
Residual factor for significantly intense reflections	0.0572
Weighted residual factors for significantly intense reflections	0.1298
Weighted residual factors for all reflections included in the refinement	0.1448
Goodness-of-fit parameter for all reflections included in the refinement	1.124
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7208534.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208534.cif
66484	2012-09-11	cif/ Adding structures of 7208533, 7208534, 7208535, 7208536 via cif-deposit CGI script.	7208534.cif