Information card for entry 7239794

Structure parameters

• Common name: 1,3-dibromoAdamantane
• Formula: C10 H14 Br2
• Calculated formula: C10 H14 Br2
• Title of publication: Polymorphism of 1,3-X-adamantanes (X=Br, OH, CH3) and the crystal plastic phase formation ability
• Authors of publication: Négrier, Philippe; Ben Hassine, Bacem; Barrio, Maria; Romanini, Michela; MONDIEIG, DENISE; Tamarit, Josep Lluis
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 14.9792 ± 0.0009 Å
• b: 9.7677 ± 0.0006 Å
• c: 7.2734 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1064.19 ± 0.12 ų
• Cell temperature: 294 ± 1 K
• Ambient diffraction temperature: 294 ± 1 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
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No