Crystallography Open Database

Information card for entry 4320346

4320345 << 4320346 >> 4320347

Preview

Coordinates	4320346.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H20 As3 F5 Fe3 N3 O12
Calculated formula	C6 H20 As3 F5 Fe3 N3 O12
Title of publication	Synthesis and Characterization of Fluorinated Metal Arsenates with a Layer Structure: (C4H12N2)1.5[M3F5(HAsO4)2(AsO4)] (M = Fe, Ga)
Authors of publication	Shi-Hao Luo; Yau-Chen Jiang; Sue-Lein Wang; Hsien-Ming Kao; Kwang-Hwa Lii
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	5381 - 5384
a	8.3944 ± 0.001 Å
b	21.992 ± 0.003 Å
c	10.8466 ± 0.0012 Å
α	90°
β	96.188 ± 0.002°
γ	90°
Cell volume	1990.7 ± 0.4 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	7
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	0.0359
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0699
Weighted residual factors for all reflections included in the refinement	0.0723
Goodness-of-fit parameter for all reflections included in the refinement	1.049
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
179306 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/03.	4320346.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4320346.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4320346.cif
17250	2011-04-06	../uploads/cif-deposit/cod/cif Adding structures of 4320346 via cif-deposit CGI script.	4320346.cif