Information card for entry 7014157

Structure parameters

• Formula: C13 H18 N3 O Rh S3
• Calculated formula: C13 H18 N3 O Rh S3
• SMILES: [Rh]1234([SH]C#N)(SC#N)(SC#N)[c]5([c]1([c]2([c]3([c]45C)C)C)C)C.O
• Title of publication: Various forms of linear dipyridyls in discrete rectangles, dinuclear rods, and one-dimensional networks containing (eta5-pentamethylcyclopentadienyl)rhodium(III).
• Authors of publication: Han, Won Seok; Lee, Soon W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 10
• Pages of publication: 1656 - 1663
• a: 16.0347 ± 0.0013 Å
• b: 8.5889 ± 0.0007 Å
• c: 13.5053 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1860 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• 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: 0.0244
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0575
• Weighted residual factors for all reflections included in the refinement: 0.0589
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No