Crystallography Open Database

Information card for entry 7208232

7208231 << 7208232 >> 7208233

Preview

Coordinates	7208232.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H11 Fe1.5 N O10 P2
Calculated formula	C8 H11 Fe1.5 N O10 P2
Title of publication	Synthesis, structures and surface photovoltage properties of four novel metal phosphonates with a 3D supramolecular structure
Authors of publication	Li, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Chen, Kai; Wang, Cheng-Lin; Zhu, Yan-Yu; Zhu, Jiang; Zhao, Yan; Zheng, Ming-Jing; Sun, Shou-Hui; Chu, Wei; Tian, Hui
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	17
Pages of publication	5479
a	9.0076 ± 0.0014 Å
b	9.0531 ± 0.0014 Å
c	10.02 ± 0.003 Å
α	101.061 ± 0.003°
β	109.377 ± 0.003°
γ	109.873 ± 0.002°
Cell volume	680.8 ± 0.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0806
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.1023
Weighted residual factors for all reflections included in the refinement	0.1192
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7208232.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208232.cif
64229	2012-08-11	cif/ Adding structures of 7208232, 7208233, 7208234, 7208235 via cif-deposit CGI script.	7208232.cif