Crystallography Open Database

Information card for entry 7205729

7205728 << 7205729 >> 7205730

Preview

Coordinates	7205729.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 Er2 O14
Calculated formula	C16 H14 Er2 O14
Title of publication	A novel family of 3D photoluminescent lanthanide‒bta‒flexible MOFs constructed from 1,2,4,5-benzenetetracarboxylic acid and different spanning of dicarboxylate acid ligands
Authors of publication	Hou, Ke-Ling; Bai, Feng-Ying; Xing, Yong-Heng; Wang, Jian-Ling; Shi, Zhan
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	11
Pages of publication	3884
a	7.7489 ± 0.0008 Å
b	7.1601 ± 0.0007 Å
c	17.294 ± 0.0018 Å
α	90°
β	91.165 ± 0.001°
γ	90°
Cell volume	959.32 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0284
Residual factor for significantly intense reflections	0.0231
Weighted residual factors for significantly intense reflections	0.0501
Weighted residual factors for all reflections included in the refinement	0.0524
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
180388 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/57.	7205729.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205729.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205729.cif
20998	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7205722, 7205723, 7205724, 7205725, 7205726, 7205727, 7205728, 7205729, 7205730, 7205731, 7205732, 7205733 via cif-deposit CGI script.	7205729.cif