Information card for entry 4310282

Structure parameters

• Formula: C106 H252 Br18 Cs0.4 K0.6 Mo18 N29 O16 S6
• Calculated formula: C105.6 Br17.448 Cs0.402 K0.6 Mo18 N29 O15.46 S6.48
• Title of publication: Synthesis and Characterization of Mo6 Chalcobromides and Cyano-Substituted Compounds Built from a Novel [(Mo6Bri6Yi2)La6]n- Discrete Cluster Unit (Yi= S or Se and La= Br or CN)
• Authors of publication: Stéphane Cordier; Nikolaï G. Naumov; Diala Salloum; Frédéric Paul; Christiane Perrin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 219 - 226
• a: 17.1969 ± 0.0004 Å
• b: 17.1969 ± 0.0004 Å
• c: 17.1969 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5085.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 9
• Space group number: 221
• Hermann-Mauguin space group symbol: P m -3 m
• Hall space group symbol: -P 4 2 3
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections included in the refinement: 0.1454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No