Information card for entry 4084332

Structure parameters

• Formula: C28 H48 N8 O8 S4 W2
• Calculated formula: C28 H48 N8 O8 S4 W2
• Title of publication: Synthesis and Characterization of Molybdenum(0) and Tungsten(0) Complexes of Tetramethylthiourea: Single-Source Precursors for MoS2and WS2
• Authors of publication: Shupp, John P.; Kinne, Adam S.; Arman, Hadi D.; Tonzetich, Zachary J.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 19
• Pages of publication: 5238
• a: 9.74 ± 0.003 Å
• b: 9.873 ± 0.003 Å
• c: 13.305 ± 0.004 Å
• α: 107.31 ± 0.002°
• β: 94.23 ± 0.03°
• γ: 119.48 ± 0.003°
• Cell volume: 1025.4 ± 0.6 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1159
• Weighted residual factors for all reflections included in the refinement: 0.1176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No