Information card for entry 4020874

Structure parameters

• Formula: C80 H76 Br2
• Calculated formula: C80 H76 Br2
• Title of publication: Molecular Crystals with Moving Parts: Synthesis, Characterization, and Crystal Packing of Molecular Gyroscopes with Methyl-Substituted Triptycyl Frames
• Authors of publication: Carlos E. Godinez; Gerardo Zepeda; Christopher J. Mortko; Hung Dang; Miguel A. García-Garibay
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 1652 - 1662
• a: 9.4694 ± 0.0011 Å
• b: 16.0213 ± 0.0018 Å
• c: 21.933 ± 0.003 Å
• α: 81.887 ± 0.002°
• β: 78.878 ± 0.002°
• γ: 89.388 ± 0.002°
• Cell volume: 3231.9 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No