Crystallography Open Database

Information card for entry 7115040

Preview

Coordinates	7115040.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H54 Co3 N18 O23 V8
Calculated formula	C60 H54 Co3 N18 O23 V8
Title of publication	A novel bimetallic cage complex constructed from six V4Co pentatomic rings: hydrothermal synthesis and crystal structure of [(2,2′-Py2NH)2Co]3V8O23
Authors of publication	Liu, Cai-Ming; Gao, Song; Wang, Zhe-Ming; Hu, Huai-Ming
Journal of publication	Chemical Communications
Year of publication	2001
Journal issue	17
Pages of publication	1636
a	22.596 ± 0.003 Å
b	22.596 ± 0.003 Å
c	27.515 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	12166 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0774
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.1397
Weighted residual factors for all reflections included in the refinement	0.1629
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
180264 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/50.	7115040.cif
118498	2014-06-30	cif/ Adding structures of 7115040 via cif-deposit CGI script.	7115040.cif