Crystallography Open Database

Information card for entry 4338143

Preview

Coordinates	4338143.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C86 H90 N4 O55 Ru20 Se8
Calculated formula	C86 H90 N4 O54.5 Ru20 Se8
Title of publication	CO and CO2 Fixation by Se-Ru-CO Hydride Clusters.
Authors of publication	Shieh, Minghuey; Chu, Yen-Yi; Jang, Li-Fing; Ho, Chia-Hua
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	9
Pages of publication	4284 - 4286
a	15.884 ± 0.0001 Å
b	20.094 ± 0.0002 Å
c	26.269 ± 0.0003 Å
α	74.7875 ± 0.0003°
β	78.0736 ± 0.0003°
γ	78.3033 ± 0.0005°
Cell volume	7817.38 ± 0.13 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0753
Residual factor for significantly intense reflections	0.051
Weighted residual factors for significantly intense reflections	0.1516
Weighted residual factors for all reflections included in the refinement	0.1713
Goodness-of-fit parameter for all reflections included in the refinement	0.828
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
179484 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/81.	4338143.cif
115752	2014-06-05	cif/ Updating files of 4338139, 4338140, 4338141, 4338142, 4338143, 4338144 Original log message: Adding full bibliography for 4338139--4338144.cif.	4338143.cif
109959	2014-04-18	cif/ Adding structures of 4338139, 4338140, 4338141, 4338142, 4338143, 4338144 via cif-deposit CGI script.	4338143.cif