Crystallography Open Database

Information card for entry 7048243

Preview

Coordinates	7048243.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H30 B N6 O4 P Ru S3
Calculated formula	C19 H30 B N6 O4 P Ru S3
Title of publication	Synthesis and ligand substitution reactions of κ<sup>4</sup>-B,S,S',S''-ruthenaboratranes.
Authors of publication	Foreman, Mark R St-J; Hill, Anthony F.; Ma, Chenxi; Tshabang, Never; White, Andrew J. P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	48
Journal issue	1
Pages of publication	209 - 219
a	13.3878 ± 0.0011 Å
b	16.5415 ± 0.0009 Å
c	25.3837 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	5621.3 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
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	0.0713
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.1343
Weighted residual factors for all reflections included in the refinement	0.147
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
223947 (current)	2019-11-07	cif/ Updating files of 7048239, 7048240, 7048241, 7048242, 7048243 Original log message: Adding full bibliography for 7048239--7048243.cif.	7048243.cif
212187	2018-11-27	cif/ Adding structures of 7048239, 7048240, 7048241, 7048242, 7048243 via cif-deposit CGI script.	7048243.cif