Information card for entry 7010525

Structure parameters

• Common name: 9 Rh6(CO)15(C8H14)
• Formula: C23 H14 O15 Rh6
• Calculated formula: C23 H14 O15 Rh6
• SMILES: [Rh]123456([Rh]789%10([Rh]%11%12%131([Rh]1%143([Rh]327([Rh]8%111([C]%10%13=O)([C]%143=O)(C#[O])C#[O])([C]59=O)(C#[O])C#[O])([C]6%12=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])C#[O])([CH]1=[CH]4CCCCCC1)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: 9.466 ± 0.002 Å
• b: 9.832 ± 0.003 Å
• c: 16.608 ± 0.004 Å
• α: 103.07 ± 0.02°
• β: 94.5 ± 0.03°
• γ: 98.62 ± 0.03°
• Cell volume: 1478.5 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1318
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for all reflections: 0.1579
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections: 0.885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No