Information card for entry 4032048

Structure parameters

• Formula: C23 H22 O2
• Calculated formula: C23 H22 O2
• Title of publication: Bridgehead vicinal diallylation of norbornene derivatives and extension to propellane derivatives via ring-closing metathesis.
• Authors of publication: Kotha, Sambasivarao; Gunta, Rama
• Journal of publication: Beilstein journal of organic chemistry
• Year of publication: 2016
• Journal volume: 12
• Pages of publication: 1877 - 1883
• a: 14.63 ± 0.007 Å
• b: 11.834 ± 0.006 Å
• c: 10.513 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1820.1 ± 1.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• 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: 0.0499
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0959
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No