Crystallography Open Database

Information card for entry 7036238

Preview

Coordinates	7036238.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Compound3
Formula	C12 H4 In2 O13
Calculated formula	C12 H4 In2 O13
Title of publication	Charge-tunable indium-organic frameworks built from cationic, anionic, and neutral building blocks.
Authors of publication	Bu, Fei; Lin, Qipu; Zhai, Quan-Guo; Bu, Xianhui; Feng, Pingyun
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	38
Pages of publication	16671 - 16674
a	10.7435 ± 0.0006 Å
b	21.4819 ± 0.0012 Å
c	10.7721 ± 0.0007 Å
α	90°
β	105.113 ± 0.001°
γ	90°
Cell volume	2400.1 ± 0.2 Å³
Cell temperature	195 ± 2 K
Ambient diffraction temperature	195 ± 2 K
Number of distinct elements	4
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0376
Residual factor for significantly intense reflections	0.0279
Weighted residual factors for significantly intense reflections	0.0774
Weighted residual factors for all reflections included in the refinement	0.0804
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	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7036238.cif
161119	2015-10-09	cif/ Updating files of 7036236, 7036237, 7036238 Original log message: Adding full bibliography for 7036236--7036238.cif.	7036238.cif
153570	2015-08-21	cif/ Adding structures of 7036236, 7036237, 7036238 via cif-deposit CGI script.	7036238.cif