Information card for entry 4020884

Structure parameters

• Formula: C15 H24 N4 O
• Calculated formula: C15 H24 N4 O
• SMILES: N12CCCC[C@@H]1[C@H]1C[C@@H](C2)[C@H]2[C@@]31N(N=N2)CCCCO3.N12CCCC[C@H]1[C@@H]1C[C@H](C2)[C@@H]2[C@]31N(N=N2)CCCCO3
• Title of publication: Base-Promoted Reactions of Bridged Ketones and 1,3- and 1,4-Haloalkyl Azides: Competitive Alkylation vs Azidation Reactions of Ketone Enolates
• Authors of publication: Lei Yao; Brenton T. Smith; Jeffrey Aubé
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 1720 - 1722
• a: 15.3827 ± 0.0007 Å
• b: 7.0604 ± 0.0003 Å
• c: 12.8704 ± 0.0006 Å
• α: 90°
• β: 91.103 ± 0.001°
• γ: 90°
• Cell volume: 1397.57 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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