Crystallography Open Database

Information card for entry 8000143

Preview

Coordinates	8000143.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H84 Co4 F24 N20 O18
Calculated formula	C88 H84 Co4 F24 N20 O18
Title of publication	Alkoxo-bridged Cobalt(II) Cube and Its Radical Adduct
Authors of publication	Mitsumoto, Kiyotaka; Koizumi, Satoshi; Shiga, Takuya; Nishikawa, Hiroyuki; Chi, Yun; Oshio, Hiroki
Journal of publication	Chemistry Letters
Year of publication	2007
Journal volume	36
Journal issue	9
Pages of publication	1154
a	18.723 ± 0.002 Å
b	18.723 ± 0.002 Å
c	30.706 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	10764 ± 2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0618
Residual factor for significantly intense reflections	0.0481
Weighted residual factors for significantly intense reflections	0.1361
Weighted residual factors for all reflections included in the refinement	0.1451
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
211175 (current)	2018-09-26	cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8.	8000143.cif
176728	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 8.	8000143.cif
94290	2014-01-22	cif/ Adding structures of 8000142, 8000143 via cif-deposit CGI script.	8000143.cif