Information card for entry 4021273

Structure parameters

• Formula: C17 H26 N P
• Calculated formula: C17 H26 N P
• SMILES: P#Cc1c(cc(N(C)C)cc1C(C)(C)C)C(C)(C)C
• Title of publication: Preparation and Properties of Phosphaethynes Bearing Bulky Aryl Groups with Electron-Donating Substituents at the Para Position
• Authors of publication: Kozo Toyota; Subaru Kawasaki; Masaaki Yoshifuji
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 5065 - 5070
• a: 10.23 ± 0.004 Å
• b: 11.19 ± 0.006 Å
• c: 14.989 ± 0.005 Å
• α: 90°
• β: 93.24 ± 0.01°
• γ: 90°
• Cell volume: 1713 ± 1 ų
• Cell temperature: 203.2 K
• Number of distinct elements: 4
• 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