Crystallography Open Database

Information card for entry 7222452

Preview

Coordinates	7222452.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	InOF-13
Chemical name	InOF-13
Formula	C22 H19 In N2 O8
Calculated formula	C22 H19 In N2 O8
Title of publication	Crystal structure, morphology and sorption behaviour of porous indium-tetracarboxylate framework materials
Authors of publication	Qian, Jinjie; Yu, Panpan; Su, Kongzhao; Dong, Youqing; Huang, Shaoming; Hong, Maochun
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	44
Pages of publication	8512
a	19.7244 ± 0.0001 Å
b	17.0814 ± 0.0001 Å
c	9.9554 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	3354.18 ± 0.04 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.0424
Residual factor for significantly intense reflections	0.0417
Weighted residual factors for significantly intense reflections	0.1155
Weighted residual factors for all reflections included in the refinement	0.1164
Goodness-of-fit parameter for all reflections included in the refinement	1.134
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
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.	7222452.cif
171046	2015-12-09	cif/ Updating files of 7222451, 7222452 Original log message: Adding full bibliography for 7222451--7222452.cif.	7222452.cif
160974	2015-10-08	cif/ Adding structures of 7222451, 7222452 via cif-deposit CGI script.	7222452.cif