Information card for entry 1004004

Structure parameters

• Common name: Tungsten sulfide cluster with
• Chemical name: octakis(mu!3$-sulfido)-hexakis(morpholine) -hexa-tungsten-1.3(morpholine)-3.7(aniline)
• Formula: C51.5 H91.5 N11 O7.25 S8 W6
• Calculated formula: C51.416 H91.584 N11 O7.292 S8 W6
• Title of publication: Synthesis, Characterization, and Ligand Exchange Studies of W~6~S~8~L~6~ Cluster Compounds
• Authors of publication: Jin, Song; Zhou, Ran; Scheuer, Ellen M.; Adamchuk, Jennifer; Rayburn, Lori L.; DiSalvo, Francis J.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Journal issue: 12
• Pages of publication: 2666 - 2674
• a: 14.8105 ± 0.0013 Å
• b: 18.5419 ± 0.0017 Å
• c: 25.108 ± 0.002 Å
• α: 90°
• β: 104.284 ± 0.002°
• γ: 90°
• Cell volume: 6681.8 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.216
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No