Information card for entry 4020748

Structure parameters

• Formula: C34 H30
• Calculated formula: C34 H30
• SMILES: Cc1ccccc1c1c(cc(c2c(C)cccc2)c(c1)c1ccccc1C)c1ccccc1C
• Title of publication: Static and Dynamic Stereochemistry of the Conformational Atropisomers of Tetra(o-tolyl)benzene
• Authors of publication: Lodovico Lunazzi; Andrea Mazzanti; Mirko Minzoni
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 10062 - 10066
• a: 11.3626 ± 0.0016 Å
• b: 8.8591 ± 0.0013 Å
• c: 13.0108 ± 0.0019 Å
• α: 90°
• β: 99.29 ± 0.002°
• γ: 90°
• Cell volume: 1292.5 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No