Information card for entry 4100378

Structure parameters

• Formula: C34 H40 Co2 N O6 P S
• Calculated formula: C34 H40 Co2 N O6 P S
• SMILES: [Co]123([Co]4([P]([C@H]5[S]1C([C@H]1[C@H](O5)C[C@@H](CC1)C)(C)C)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])[CH]2=[C]34C(=O)N(CC)CC)(C#[O])C#[O]
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 10.3233 ± 0.0006 Å
• b: 11.2864 ± 0.0006 Å
• c: 31.2034 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3635.6 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No