Information card for entry 4300460

Structure parameters

• Formula: C31 H52 B Cu N6 O
• Calculated formula: C31 H52 B Cu N6 O
• SMILES: C([Cu]12[n]3c(C(C)(C)C)cc(C(C)C)n3[BH](n3c(cc(C(C)(C)C)[n]13)C(C)C)n1c(cc(C(C)(C)C)[n]21)C(C)C)#[O]
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 10.592 ± 0.001 Å
• b: 17.145 ± 0.001 Å
• c: 9.741 ± 0.002 Å
• α: 90°
• β: 104.2 ± 0.01°
• γ: 90°
• Cell volume: 1714.9 ± 0.8 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 6
• 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