Information card for entry 4100735

Structure parameters

• Formula: C8 H7 B F3 N O3
• Calculated formula: C8 H7 B F3 N O3
• SMILES: F[B](F)(F)[O]=C(C)c1ccc(N(=O)=O)cc1
• Title of publication: Chelate and pincer carbene complexes of rhodium and platinum derived from hexaphenylcarbodiphosphorane, Ph3P=C=PPh3
• Authors of publication: Kubo, Kazuyuki; Jones, Nathan D.; Ferguson, Michael J.; McDonald, Robert; Cavell, Ronald G.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 6.018 ± 0.0018 Å
• b: 14.64 ± 0.004 Å
• c: 11.003 ± 0.003 Å
• α: 90°
• β: 92.89 ± 0.006°
• γ: 90°
• Cell volume: 968.2 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No