Crystallography Open Database

Information card for entry 7015689

Preview

Coordinates	7015689.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(Ru(EtOtpy)(bpy)(H2O))(NO3)2 - 2.5(H2O)
Formula	C27 H30 N7 O10.5 Ru
Calculated formula	C27 H25 N7 O10.5 Ru
Title of publication	Highly active and tunable catalysts for O2 evolution from water based on mononuclear ruthenium(II) monoaquo complexes.
Authors of publication	Yagi, Masayuki; Tajima, Syouhei; Komi, Manabu; Yamazaki, Hirosato
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	15
Pages of publication	3802 - 3804
a	11.0976 ± 0.0007 Å
b	11.4129 ± 0.0007 Å
c	13.8155 ± 0.0008 Å
α	91.808 ± 0.005°
β	102.944 ± 0.005°
γ	115.411 ± 0.002°
Cell volume	1524.08 ± 0.17 Å³
Cell temperature	296.2 K
Ambient diffraction temperature	296.2 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 significantly intense reflections	0.051
Weighted residual factors for all reflections included in the refinement	0.137
Goodness-of-fit parameter for all reflections included in the refinement	1.258
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7015689.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7015689.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7015689.cif
21219	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7015689 via cif-deposit CGI script.	7015689.cif