Crystallography Open Database

Information card for entry 4117579

Preview

Coordinates	4117579.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H41 Eu2 N O24
Calculated formula	C33 H29 Eu2 N O23.99
Title of publication	A Luminescent Mixed-Lanthanide Metal-Organic Framework Thermometer
Authors of publication	Yuanjing Cui; Hui Xu; Yanfeng Yue; Zhiyong Guo; Jiancan Yu; Zhenxia Chen; Junkuo Gao; Yu Yang; Guodong Qian; Banglin Chen
Journal of publication	Journal of the American Chemical Society
Year of publication	2012
Journal volume	134
Pages of publication	3979 - 3982
a	9.9484 ± 0.0008 Å
b	20.9541 ± 0.0017 Å
c	19.5857 ± 0.0016 Å
α	90°
β	104.256 ± 0.001°
γ	90°
Cell volume	3957.1 ± 0.6 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	0.0443
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for significantly intense reflections	0.1025
Weighted residual factors for all reflections included in the refinement	0.1264
Goodness-of-fit parameter for all reflections included in the refinement	1.123
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
178946 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/75.	4117579.cif
74699	2013-03-03	cif/ Adding structures of 4117579 via cif-deposit CGI script.	4117579.cif