Crystallography Open Database

Information card for entry 4305296

Preview

Coordinates	4305296.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H50 Cl2 N3 O2 Ru
Calculated formula	C32 H50 Cl2 N3 O2 Ru
SMILES	[Ru]123(Cl)(Cl)Oc4c(C=[N]2CC[N]3=Cc2c(O1)cccc2)cccc4.[N+](CCCC)(CCCC)(CCCC)CCCC
Title of publication	General Synthesis of (Salen)ruthenium(III) Complexes via N...N Coupling of (Salen)ruthenium(VI) Nitrides
Authors of publication	Wai-Lun Man; Hoi-Ki Kwong; William W. Y. Lam; Jing Xiang; Tsz-Wing Wong; Wing-Hong Lam; Wing-Tak Wong; Shie-Ming Peng; Tai-Chu Lau
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	5936 - 5944
a	11.817 ± 0.003 Å
b	13.209 ± 0.003 Å
c	22.033 ± 0.004 Å
α	90°
β	97.76 ± 0.02°
γ	90°
Cell volume	3407.7 ± 1.3 Å³
Cell temperature	298 ± 1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.055
Weighted residual factors for all reflections included in the refinement	0.066
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4305296.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4305296.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4305296.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	4305296.cif