Crystallography Open Database

Information card for entry 1565803

Preview

Coordinates	1565803.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H26 Ru S4
Calculated formula	C30 H26 Ru S4
SMILES	[Ru]12345([S]=C(S1)c1cccc6ccccc16)([S]=C(S2)c1cccc2ccccc12)[CH]1=[CH]3CC[CH]4=[CH]5CC1
Title of publication	Ruthenium(II) complexes with α- or β-dithionaphthoato ligands
Authors of publication	Li, Guo-Qiang; Chen, Chong; Ji, Jiao; Jia, Ai-Quan; Zhang, Qian-Feng
Journal of publication	Inorganica Chimica Acta
Year of publication	2019
Journal volume	498
Pages of publication	119173
a	9.05 ± 0.01 Å
b	19.19 ± 0.02 Å
c	14.836 ± 0.018 Å
α	90°
β	97.518 ± 0.019°
γ	90°
Cell volume	2554 ± 5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
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	0.2465
Residual factor for significantly intense reflections	0.0784
Weighted residual factors for significantly intense reflections	0.1628
Weighted residual factors for all reflections included in the refinement	0.2505
Goodness-of-fit parameter for all reflections included in the refinement	0.88
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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