Information card for entry 1545531

Structure parameters

• Chemical name: AdamPPCO
• Formula: C38 H53 N3 O P2
• Calculated formula: C38 H53 N3 O P2
• Title of publication: (Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
• Authors of publication: Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
• Journal of publication: Chem. Sci.
• Year of publication: 2017
• Journal volume: 8
• Journal issue: 5
• Pages of publication: 3720
• a: 21.5089 ± 0.0011 Å
• b: 17.8123 ± 0.0009 Å
• c: 9.2449 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3541.9 ± 0.3 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0724
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No