Information card for entry 7010526

Structure parameters

• Common name: 10 Rh6(CO)16)
• Formula: C16 O16 Rh6
• Calculated formula: C16 O16 Rh6
• SMILES: [Rh]12345([Rh]6789([Rh]%10%111([Rh]1%12%132([Rh]236([Rh]7%101([C]92=O)([C]%11%13=O)(C#[O])C#[O])([C]5%12=O)(C#[O])C#[O])(C#[O])C#[O])([C]48=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])C#[O]
• Title of publication: Ligand effects on the structures of Rh6(CO)15L clusters
• Authors of publication: Farrar, David H.; Grachova, Elena V.; Lough, Alan; Patirana, Charles; Poë, Anthony J.; Tunik, Sergey P.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 13
• Pages of publication: 2015
• a: 16.113 ± 0.003 Å
• b: 9.55 ± 0.002 Å
• c: 17.013 ± 0.003 Å
• α: 90°
• β: 104.89 ± 0.03°
• γ: 90°
• Cell volume: 2530 ± 0.9 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 3
• 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: 0.104
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for all reflections: 0.1179
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections: 0.942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No