Crystallography Open Database

Information card for entry 7711842

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Coordinates	7711842.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Ru-ttpy-sac-pz
Formula	C36 H24 N7 O6 Ru S3
Calculated formula	C36 H24 N7 O6 Ru S3
Title of publication	Quaternary Ru(II) complexes of terpyridines, saccharin and 1,2-azoles: effect of substituents on molecular structure, speciation, photoactivity, and photocytotoxicity.
Authors of publication	Kumar, Priyaranjan; Singh, Prerana; Saren, Sanjoy; Sayala, Juhi; Sivakumar, Sri; Patra, Ashis K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
a	11.9146 ± 0.0005 Å
b	16.9265 ± 0.0007 Å
c	32.3157 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	6517.2 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0554
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.0833
Weighted residual factors for all reflections included in the refinement	0.0936
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
279520 (current)	2022-11-24	cif/ Adding structures of 7711837, 7711838, 7711839, 7711840, 7711841, 7711842 via cif-deposit CGI script.	7711842.cif