Crystallography Open Database

Information card for entry 1508096

Preview

Coordinates	1508096.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H16 Co N10 S2
Calculated formula	C26 H16 Co N10 S2
Title of publication	Networked molecular cages as crystalline sponges for fullerenes and other guests.
Authors of publication	Inokuma, Yasuhide; Arai, Tatsuhiko; Fujita, Makoto
Journal of publication	Nature chemistry
Year of publication	2010
Journal volume	2
Journal issue	9
Pages of publication	780 - 783
a	37.461 ± 0.005 Å
b	37.461 ± 0.005 Å
c	37.461 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	52570 ± 12 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	5
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.1286
Residual factor for significantly intense reflections	0.0998
Weighted residual factors for significantly intense reflections	0.283
Weighted residual factors for all reflections included in the refinement	0.2978
Goodness-of-fit parameter for all reflections included in the refinement	2.013
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1508096.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1508096.cif
62642	2012-07-09	cif/ Adding structures of 1508096 via cif-deposit CGI script.	1508096.cif