Crystallography Open Database

Information card for entry 7060894

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Coordinates	7060894.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H21 Cl2 N O3 Ru S3
Calculated formula	C8 H21 Cl2 N O3 Ru S3
Title of publication	Ru(ii)- and Ru(iv)-dmso complexes catalyze efficient and selective aqueous-phase nitrile hydration reactions under mild conditions
Authors of publication	Trivedi, Manoj; Dubey, Santosh Kumar; Kaur, Gurmeet; Rath, Nigam P.
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	37
Pages of publication	17339 - 17346
a	13.6347 ± 0.0003 Å
b	10.9933 ± 0.0002 Å
c	11.307 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	1694.81 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0263
Residual factor for significantly intense reflections	0.0246
Weighted residual factors for significantly intense reflections	0.0609
Weighted residual factors for all reflections included in the refinement	0.062
Goodness-of-fit parameter for all reflections included in the refinement	0.966
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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