Information card for entry 7051494

Structure parameters

• Formula: C17 H26 B N6 Tl
• Calculated formula: C17 H26 B N6 Tl
• SMILES: [Tl]12[n]3[n]([BH]([n]4[n]1ccc4)[n]1[n]2c(cc1C(C)(C)C)C(C)(C)C)ccc3
• Journal of publication: New Journal of Chemistry
• Year of publication: 1999
• a: 10.3 ± 0.003 Å
• b: 10.286 ± 0.003 Å
• c: 18.917 ± 0.005 Å
• α: 90°
• β: 99.77 ± 0.007°
• γ: 90°
• Cell volume: 1975.1 ± 1 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 2 K
• Number of distinct elements: 5
• 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