Crystallography Open Database

Information card for entry 7014392

Preview

Coordinates	7014392.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H28 N3 O6 Ru
Calculated formula	C21 H28 N3 O6 Ru
Title of publication	Mono and dinuclear arene ruthenium(II) triazoles by 1,3-dipolar cycloadditions to a coordinated azide in ruthenium(II) compounds.
Authors of publication	Singh, Keisham Sarjit; Svitlyk, Volodymyr; Mozharivskyj, Yurij
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	5
Pages of publication	1020 - 1023
a	8.5202 ± 0.001 Å
b	11.2899 ± 0.0012 Å
c	12.7502 ± 0.0014 Å
α	95.894 ± 0.009°
β	102.64 ± 0.009°
γ	109.373 ± 0.009°
Cell volume	1108.3 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1758
Residual factor for significantly intense reflections	0.0536
Weighted residual factors for significantly intense reflections	0.0653
Weighted residual factors for all reflections included in the refinement	0.085
Goodness-of-fit parameter for all reflections included in the refinement	0.664
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
179847 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/43.	7014392.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7014392.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7014392.cif
14743	2011-03-11	../uploads/cif-deposit/cod/cif Adding structures of 7014392, 7014393 via cif-deposit CGI script.	7014392.cif