Crystallography Open Database

Information card for entry 7206963

7206962 << 7206963 >> 7206964

Preview

Coordinates	7206963.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H8 La N O8
Calculated formula	C9 H8 La N O8
Title of publication	Lanthanide-pyridyl-2,5-dicarboxylate N-oxide frameworks with rutile topology
Authors of publication	Sun, Hao-Ling; Wang, Xiang-Li; Jia, Li; Cao, Wei; Wang, Ke-Zhi; Du, Miao
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	2
Pages of publication	512
a	9.9138 ± 0.0001 Å
b	14.9969 ± 0.0002 Å
c	8.5545 ± 0.0001 Å
α	90°
β	98.582 ± 0.001°
γ	90°
Cell volume	1257.61 ± 0.03 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	0.0294
Residual factor for significantly intense reflections	0.0247
Weighted residual factors for significantly intense reflections	0.0563
Weighted residual factors for all reflections included in the refinement	0.0586
Goodness-of-fit parameter for all reflections included in the refinement	1.052
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
180400 (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 7/20/69.	7206963.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206963.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206963.cif
32449	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 7206961, 7206962, 7206963, 7206964 via cif-deposit CGI script.	7206963.cif