Crystallography Open Database

Information card for entry 4339568

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Coordinates	4339568.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H8 In2 O9
Calculated formula	C16 H8 In2 O9
Title of publication	Influence of ligand geometry on the formation of In-O chains in metal-oxide organic frameworks (MOOFs).
Authors of publication	Vougo-Zanda, Marie; Wang, Xiqu; Jacobson, Allan J.
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	21
Pages of publication	8819 - 8824
a	16.0978 ± 0.0008 Å
b	16.0978 ± 0.0008 Å
c	5.9217 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	1534.54 ± 0.19 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	4
Space group number	138
Hermann-Mauguin space group symbol	P 42/n c m :2
Hall space group symbol	-P 4ac 2ac
Residual factor for all reflections	0.0185
Residual factor for significantly intense reflections	0.0159
Weighted residual factors for significantly intense reflections	0.0426
Weighted residual factors for all reflections included in the refinement	0.0437
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
179498 (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 4/33/95.	4339568.cif
117397	2014-06-14	cif/ Adding structures of 4339568 via cif-deposit CGI script.	4339568.cif