Information card for entry 2240143

Structure parameters

• Chemical name: Decacarbonyltetra-μ~4~-oxido-hexa-μ~3~-oxido-tetrakis[μ-2,2'-(pyridine-2,6-diyl)bis(1,1-diphenylethanolato)] decatin(II)ditin(IV)dimolybdenum(O)(2 <i>Mo</i>—<i>Sn</i>) toluene heptasolvate
• Formula: C191 H164 Mo2 N4 O28 Sn12
• Calculated formula: C191 H164 Mo2 N4 O28 Sn12
• Title of publication: Crystal structure of a mixed-valence μ-oxide Sn~12~ cluster
• Authors of publication: Kireenko, Marina M.; Zaitsev, Kirill V.; Karlov, Sergey S.; Egorov, Mikhail P.; Churakov, Andrei V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 11
• Pages of publication: m378 - m379
• a: 15.8218 ± 0.0017 Å
• b: 15.9933 ± 0.0017 Å
• c: 18.806 ± 0.002 Å
• α: 94.833 ± 0.002°
• β: 95.014 ± 0.002°
• γ: 110.605 ± 0.002°
• Cell volume: 4403.4 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0428
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0757
• Weighted residual factors for all reflections included in the refinement: 0.0813
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes