Information card for entry 4061718

Structure parameters

• Formula: C47 H35 D6 F3 N2 O3 P Rh
• Calculated formula: C47 H41 F3 N2 O3 P Rh
• SMILES: [Rh]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)(C(F)(F)F)([CH]2=[CH]1C(=O)OC2=O)(C#[N]c1c(cccc1C)C)C#[N]c1c(cccc1C)C.c1ccccc1
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 9.4633 ± 0.0004 Å
• b: 14.573 ± 0.0006 Å
• c: 14.9666 ± 0.0006 Å
• α: 86.404 ± 0.002°
• β: 83.216 ± 0.002°
• γ: 81.008 ± 0.002°
• Cell volume: 2022.32 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No