Crystallography Open Database

Information card for entry 4105302

Preview

Coordinates	4105302.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H117 In3 N3 O24
Calculated formula	C84 H117 In3 N3 O24
Title of publication	Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties
Authors of publication	Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	16027 - 16029
a	29.155 ± 0.002 Å
b	29.155 ± 0.002 Å
c	17.367 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	12784 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	161
Hermann-Mauguin space group symbol	R 3 c :H
Hall space group symbol	R 3 -2"c
Residual factor for all reflections	0.0732
Residual factor for significantly intense reflections	0.0584
Weighted residual factors for significantly intense reflections	0.1289
Weighted residual factors for all reflections included in the refinement	0.147
Goodness-of-fit parameter for all reflections included in the refinement	1.052
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
178799 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/53.	4105302.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4105302.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4105302.cif
30497	2011-11-13	../uploads/cif-deposit/cod/cif Adding structures of 4105302 via cif-deposit CGI script.	4105302.cif