Crystallography Open Database

Information card for entry 7217002

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Coordinates	7217002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H26 Fe N4 O8
Calculated formula	C35 H26 Fe N4 O8
Title of publication	Syntheses, Structures, and Luminescence Properties of Four Metal-Organic Polymers With Undocumented Topologies Constructed From 3,5-Bis((4'-carboxylbenzyl)oxy)benzoate Ligand
Authors of publication	zhang, xiutang; Fan, Liming; Song, Weikuo; Fan, Weiliu; Sun, Liming; Zhao, Xian
Journal of publication	RSC Advances
Year of publication	2014
a	26.4977 ± 0.0019 Å
b	8.1948 ± 0.0006 Å
c	26.8556 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	5831.5 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0731
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.0905
Weighted residual factors for all reflections included in the refinement	0.0984
Goodness-of-fit parameter for all reflections included in the refinement	1.007
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
180501 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/70.	7217002.cif
118832	2014-07-01	cif/ Adding structures of 7216999, 7217000, 7217001, 7217002 via cif-deposit CGI script.	7217002.cif