Crystallography Open Database

Information card for entry 7238934

Preview

Coordinates	7238934.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H52 N6 O2 Ru
Calculated formula	C38 H48 N6 O2 Ru
Title of publication	Isotope effect of crystal water on emission lifetime of Ru(dbb)2(CN)2·2H2O (dbb = 4,4′-di-tert-butyl-2,2′-bipyridine) crystal
Authors of publication	Shinozaki, Kazuteru; Tenmyo, Kazuhiro; Suzuki, Takayoshi
Journal of publication	RSC Advances
Year of publication	2013
Journal volume	3
Journal issue	20
Pages of publication	7579
a	17.7803 ± 0.0006 Å
b	11.8826 ± 0.0007 Å
c	35.7471 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	7552.5 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0894
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for significantly intense reflections	0.1191
Weighted residual factors for all reflections included in the refinement	0.1408
Goodness-of-fit parameter for all reflections included in the refinement	1.097
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7238934.html