Information card for entry 4063024

Structure parameters

• Formula: C29 H43 B K2 N6 O2
• Calculated formula: C29 H43 B K2 N6 O2
• SMILES: [K]([O]1CCCC1)[O]1CCCC1.[B](n1nc(cc1)C)(n1nc(cc1)C)(=C1C(=C(C(=C1C)C)C)C)n1nc(cc1)C.[K+]
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 11.9893 ± 0.0015 Å
• b: 15.4349 ± 0.0018 Å
• c: 19.073 ± 0.003 Å
• α: 90°
• β: 104.833 ± 0.014°
• γ: 90°
• Cell volume: 3411.9 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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