Information card for entry 4061222

Structure parameters

• Formula: C16 H23 O4 Rh
• Calculated formula: C16 H19 O4 Rh
• SMILES: [Rh]123456789([C]%10(=O)[CH]1=[CH]2[C]3(=O)[CH]4=[CH]5%10)[c]1([c]6([c]7([c]8([c]91C)C)C)C)C.O.O
• Title of publication: eta5-Semiquinone Complexes and the Related p- eta4-Benzoquinone of Pentamethylcyclopentadienyl-Rhodium and -Iridium: Synthesis, Structures, Hydrogen Bonding and Electrochemical Behavior
• Authors of publication: Jamal Moussa; Carine Guyard-Duhayon; Patrick Herson; Marie Noelle Rager; Hani Amouri; Anny Jutand
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 13.9281 ± 0.0008 Å
• b: 14.398 ± 0.003 Å
• c: 15.554 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3119.1 ± 1 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P c a b
• Hall space group symbol: -P 2bc 2ac
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No