Information card for entry 4304134

Structure parameters

• Common name: Cy3PTe
• Formula: C18 H33 P Te
• Calculated formula: C18 H33 P Te
• SMILES: [Te]=[P](C1CCCCC1)(C1CCCCC1)C1CCCCC1
• Title of publication: Thermodynamic, Kinetic, and Computational Study of Heavier Chalcogen (S, Se, and Te) Terminal Multiple Bonds to Molybdenum, Carbon, and Phosphorus
• Authors of publication: James E. McDonough; Arjun Mendiratta; John J. Curley; George C. Fortman; Serena Fantasia; Christopher C. Cummins; Elena V. Rybak-Akimova; Steven P. Nolan; Carl D. Hoff
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 2133 - 2141
• a: 7.5321 ± 0.0005 Å
• b: 11.0005 ± 0.0007 Å
• c: 11.6752 ± 0.0009 Å
• α: 103.579 ± 0.002°
• β: 100.226 ± 0.002°
• γ: 93.186 ± 0.002°
• Cell volume: 920.6 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0765
• Weighted residual factors for all reflections included in the refinement: 0.0777
• Goodness-of-fit parameter for all reflections included in the refinement: 1.159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No