Crystallography Open Database

Information card for entry 4084215

Preview

Coordinates	4084215.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H13 Cl N2 Ru
Calculated formula	C15 H13 Cl N2 Ru
SMILES	[Ru]12345(Cl)([n]6c(cccc6)c6[n]1cccc6)[cH]1[cH]5[cH]4[cH]3[cH]21
Title of publication	Coordinating Tectons: Bimetallic Complexes from Bipyridyl Terminated Group 8 Alkynyl Complexes
Authors of publication	Koutsantonis, George A.; Low, Paul J.; Mackenzie, Campbell F. R.; Skelton, Brian W.; Yufit, Dmitry S.
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	18
Pages of publication	4911
a	10.3949 ± 0.0001 Å
b	8.0639 ± 0.0001 Å
c	15.9581 ± 0.0002 Å
α	90°
β	101.552 ± 0.001°
γ	90°
Cell volume	1310.57 ± 0.03 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0308
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.072
Goodness-of-fit parameter for all reflections included in the refinement	1.081
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4084215.cif
126004	2014-10-30	cod/ (saulius@kolibris) Adding full bibliographies to the recently deposited structures from RSS feeds.	4084215.cif
122156	2014-08-18	cif/ Adding structures of 4084203, 4084204, 4084205, 4084206, 4084207, 4084208, 4084209, 4084210, 4084211, 4084212, 4084213, 4084214, 4084215 via cif-deposit CGI script.	4084215.cif