Crystallography Open Database

Information card for entry 4309264

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Coordinates	4309264.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H2 Fe O7 P2
Calculated formula	C2 H7 Fe O7 P2
Title of publication	Pillared Layered Structures Based upon M(III) Ethylene Diphosphonates: The Synthesis and Crystal Structures of MIII(H2O)(HO3P(CH2)2PO3) (M = Fe, Al, Ga)
Authors of publication	Crystal A. Merrill; Anthony K. Cheetham
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	5273 - 5277
a	9.739 ± 0.005 Å
b	9.498 ± 0.005 Å
c	15.94 ± 0.008 Å
α	90°
β	90°
γ	90°
Cell volume	1474.5 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0591
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.0918
Weighted residual factors for all reflections included in the refinement	0.0996
Goodness-of-fit parameter for all reflections included in the refinement	0.988
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
179130 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/92.	4309264.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4309264.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4309264.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4309264.cif