Information card for entry 4114173

Structure parameters

• Chemical name: Carbon Tetrabromide
• Formula: C Br4
• Calculated formula: C Br4
• SMILES: C(Br)(Br)(Br)Br
• Title of publication: The Charge-Transfer Motif in Crystal Engineering. Self-Assembly of Acentric (Diamondoid) Networks from Halide Salts and Carbon Tetrabromide as Electron-Donor/Acceptor Synthons
• Authors of publication: Sergey V. Lindeman; Jürgen Hecht; Jay K. Kochi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 11597 - 11606
• a: 21.086 ± 0.002 Å
• b: 11.8827 ± 0.001 Å
• c: 20.674 ± 0.002 Å
• α: 90°
• β: 111.38 ± 0.002°
• γ: 90°
• Cell volume: 4823.6 ± 0.8 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 2
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0888
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for all reflections: 0.1239
• Weighted residual factors for significantly intense reflections: 0.0959
• Goodness-of-fit parameter for all reflections: 1.008
• Goodness-of-fit parameter for significantly intense reflections: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No