Crystallography Open Database

Information card for entry 7235667

Preview

Coordinates	7235667.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H18 Cl2 N4 Ru S
Calculated formula	C15 H18 Cl2 N4 Ru S
Title of publication	Mitigating UVA light induced reactivity of 6-thioguanine through formation of a Ru(ii) half-sandwich complex
Authors of publication	Mitra, Raja; Samuelson, Ashoka G.
Journal of publication	RSC Adv.
Year of publication	2014
Journal volume	4
Journal issue	46
Pages of publication	24304
a	11.151 ± 0.003 Å
b	12.316 ± 0.003 Å
c	13.284 ± 0.004 Å
α	90°
β	102.498 ± 0.016°
γ	90°
Cell volume	1781.1 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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 all reflections	0.2041
Residual factor for significantly intense reflections	0.0664
Weighted residual factors for significantly intense reflections	0.0769
Weighted residual factors for all reflections included in the refinement	0.1025
Goodness-of-fit parameter for all reflections included in the refinement	0.961
Diffraction radiation wavelength	0.71073 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/7235667.html