Information card for entry 4061956

Structure parameters

• Formula: C48 H54 Si6
• Calculated formula: C48 H54 Si6
• SMILES: [Si]1([Si]([Si]([Si]([Si]([Si]1(C)C)(C)C)(C)c1ccc2ccc3cccc4ccc1c2c34)(C)C)(C)C)(C)c1ccc2ccc3cccc4ccc1c2c34.c1ccccc1
• Title of publication: Synthesis and structure of cis-1,4-di(1-pyrenyl)decamethylcyclohexasilane
• Authors of publication: Kaats-Richters, Veronica E.M.; Cleij, Thomas J.; Jenneskens, Leonardus W.; Lutz, Martin; Spek, Anthony L.; van Walree, Cornelis A.
• Journal of publication: Organometallics
• Year of publication: 2003
• a: 20.8757 ± 0.0005 Å
• b: 10.0414 ± 0.0002 Å
• c: 23.4955 ± 0.0006 Å
• α: 90°
• β: 115.478 ± 0.0008°
• γ: 90°
• Cell volume: 4446.18 ± 0.18 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 K
• Number of distinct elements: 3
• 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