Crystallography Open Database

Information card for entry 7206538

7206537 << 7206538 >> 7206539

Preview

Coordinates	7206538.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H12 Gd N O7
Calculated formula	C13 H12 Gd N O7
Title of publication	Crystallographic studies into the role of exposed rare earth metal ion for guest sorption
Authors of publication	Xie, Lin-Hua; Wang, Yu; Liu, Xiao-Min; Lin, Jian-Bin; Zhang, Jie-Peng; Chen, Xiao-Ming
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	19
Pages of publication	5849
a	10.3149 ± 0.0014 Å
b	10.3149 ± 0.0014 Å
c	14.339 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	1525.6 ± 0.5 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	5
Space group number	91
Hermann-Mauguin space group symbol	P 41 2 2
Hall space group symbol	P 4w 2c
Residual factor for all reflections	0.0379
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for significantly intense reflections	0.0828
Weighted residual factors for all reflections included in the refinement	0.0847
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
180396 (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 7/20/65.	7206538.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206538.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206538.cif
28007	2011-10-13	../uploads/cif-deposit/cod/cif Adding structures of 7206530, 7206531, 7206532, 7206533, 7206534, 7206535, 7206536, 7206537, 7206538 via cif-deposit CGI script.	7206538.cif