Information card for entry 4020952

Structure parameters

• Common name: 10(5)kappa_p-xylene
• Formula: C35 H40 Se6
• Calculated formula: C35 H40 Se6
• Title of publication: Cyclic Tetra- and Hexaynes Containing 1,4-Donor-Substituted Butadiyne Units: Synthesis and Supramolecular Organization
• Authors of publication: Daniel B. Werz; Rolf Gleiter; Frank Rominger
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 2945 - 2952
• a: 9.7177 ± 0.0005 Å
• b: 14.7028 ± 0.0008 Å
• c: 14.9561 ± 0.0008 Å
• α: 114.526 ± 0.002°
• β: 103.21 ± 0.001°
• γ: 101.399 ± 0.001°
• Cell volume: 1786.45 ± 0.16 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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