Information card for entry 4100015

Structure parameters

• Formula: C34 H42 Si2
• Calculated formula: C34 H42 Si2
• Title of publication: Polyynes as a model for carbyne: synthesis, physical and nonlinear optical properties
• Authors of publication: Eisler, Sara; .; Slepkov, Aaron D.; .; Elliott, Erin; .; Luu, Thanh; .; McDonald, Robert; .; Hegmann, Frank A.; .; Tykwinski, Rik R.; .
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 7.6441 ± 0.0014 Å
• b: 12.485 ± 0.002 Å
• c: 18.3 ± 0.003 Å
• α: 70.701 ± 0.004°
• β: 82.758 ± 0.004°
• γ: 80.5 ± 0.004°
• Cell volume: 1620.9 ± 0.5 ų
• Cell temperature: 193 ± 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