Information card for entry 7100895

Structure parameters

• Formula: C19 H24 N2
• Calculated formula: C19 H24 N2
• SMILES: N12C=CC(=CC2=C2N([C]1)C=CC(=C2)C(C)(C)C)C(C)(C)C
• Title of publication: First X-ray Crystal Structures of 10π- and 14π-electron Pyrido-annelated N- heterocyclic Carbenes
• Authors of publication: M. Nonnenmacher; D. Kunz; F. Rominger; T. Oeser
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 12.052 ± 0.007 Å
• b: 11.18 ± 0.006 Å
• c: 11.965 ± 0.007 Å
• α: 90°
• β: 97.78 ± 0.01°
• γ: 90°
• Cell volume: 1597.2 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No