Crystallography Open Database

Information card for entry 7218637

Preview

Coordinates	7218637.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H40 B10 Co N3 O6 S3
Calculated formula	C25 H40 B10 Co N5 O4 S3
Title of publication	Investigation into the reactivity of 16-electron complexes Cp#Co(S2C2B10H10) (Cp# = Cp, Cp*) towards methyl diazoacetate and toluenesulphonyl azide
Authors of publication	Zhong, Wei; Xie, Mingshi; Li, Yizhi; Yan, Hong
Journal of publication	RSC Adv.
Year of publication	2014
a	15.4506 ± 0.001 Å
b	13.6578 ± 0.0009 Å
c	34.644 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	7310.6 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.149
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.0736
Weighted residual factors for all reflections included in the refinement	0.082
Goodness-of-fit parameter for all reflections included in the refinement	0.986
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
180517 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/86.	7218637.cif
126138	2014-11-01	cif/ Adding structures of 7218636, 7218637, 7218638, 7218639, 7218640, 7218641, 7218642 via cif-deposit CGI script.	7218637.cif