Information card for entry 7100891

Structure parameters

• Formula: C31 H50 B Li N8 O4
• Calculated formula: C31 H50 B Li N8 O4
• SMILES: O1CC(c2[n]3[n](cc2)[Li]2([n]4[n](ccc4C(C)(C)COC)[B]13[n]1[n]2c(cc1)C(C)(C)COC)[n]1[nH]c(cc1)C(C)(C)COC)(C)C
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 11.365 ± 0.002 Å
• b: 14.028 ± 0.002 Å
• c: 22.125 ± 0.003 Å
• α: 90°
• β: 103.156 ± 0.008°
• γ: 90°
• Cell volume: 3434.8 ± 0.9 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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