Crystallography Open Database

Information card for entry 4308354

Preview

Coordinates	4308354.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[In2(btc)2(mu-OH)2].2nHpy
Formula	C28 H20 In2 N2 O14
Calculated formula	C28 H18 In2 N2 O14
Title of publication	New 3-D Chiral Framework of Indium with 1,3,5-Benzenetricarboxylate
Authors of publication	Zhengzhong Lin; Feilong Jiang; Lian Chen; Daqiang Yuan; Maochun Hong
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	73 - 76
a	7.3181 ± 0.0012 Å
b	17.02 ± 0.002 Å
c	10.5789 ± 0.0017 Å
α	90°
β	102.651 ± 0.006°
γ	90°
Cell volume	1285.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0747
Residual factor for significantly intense reflections	0.0608
Weighted residual factors for significantly intense reflections	0.1301
Weighted residual factors for all reflections included in the refinement	0.1436
Goodness-of-fit parameter for all reflections included in the refinement	1.001
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
179121 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/83.	4308354.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308354.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308354.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4308354.cif