Information card for entry 4100123

Structure parameters

• Formula: C23 H18 Mn O2 P
• Calculated formula: C23 H18 Mn O2 P
• SMILES: C1=Cc2c(C=C[P]1(c1ccccc1)[Mn]1345(C#[O])([cH]6[cH]5[cH]3[cH]1[cH]46)C#[O])cccc2
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 8.8819 ± 0.0001 Å
• b: 10.268 ± 0.0001 Å
• c: 10.9361 ± 0.0001 Å
• α: 90°
• β: 108.66 ± 0.0004°
• γ: 90°
• Cell volume: 944.939 ± 0.017 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No