Crystallography Open Database

Information card for entry 4335005

Preview

Coordinates	4335005.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H10 Gd N3 O11 P2
Calculated formula	C6 H10 Gd N3 O11 P2
Title of publication	Photoluminescent 3D Lanthanide-Organic Frameworks Based on 2,5-Dioxo-1,4-piperazinylbis(methylphosphonic) Acid Formed via in Situ Cyclodehydration of Glyphosates
Authors of publication	Yunshan Zhou; Yan Guo; Sheng Xu; Lijuan Zhang; Waqar Ahmad; Zonghai Shi
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	6338 - 6345
a	13.698 ± 0.003 Å
b	10.82 ± 0.002 Å
c	9.954 ± 0.002 Å
α	90°
β	107.16 ± 0.03°
γ	90°
Cell volume	1409.6 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0171
Residual factor for significantly intense reflections	0.0165
Weighted residual factors for significantly intense reflections	0.0425
Weighted residual factors for all reflections included in the refinement	0.0427
Goodness-of-fit parameter for all reflections included in the refinement	1.21
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
179453 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/50.	4335005.cif
100909	2014-02-10	cif/ Adding structures of 4335005 via cif-deposit CGI script.	4335005.cif