Information card for entry 2013146

Structure parameters

• Chemical name: Dichloro[2,2'-(5,9-dithia-2,12-diazoniatrideca-1,12-diene-1,13- diyl)dinaphthalenolato-κ^2^O,O']dimethyltin(IV) acetonitrile solvate
• Formula: C33 H39 Cl2 N3 O2 S2 Sn
• Calculated formula: C33 H38.412 Cl2 N3 O2 S2 Sn
• Title of publication: Dichloro[1,1'-(5,9-dithia-2,12-diazoniatrideca-1,12-diene-1,13-diyl)dinaphthalen-2-olato-κ^2^<i>O</i>,<i>O</i>']dimethyltin(IV) acetonitrile solvate
• Authors of publication: Bajue, Stanley A.; Gumbs, Shellie; Jones, Lauren; Bramwell, Fitzgerald B.; Patrick, Brian O.; Selegue, John P.; Brock, Carolyn Pratt
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: m10 - m12
• a: 12.334 ± 0.002 Å
• b: 12.765 ± 0.002 Å
• c: 12.832 ± 0.002 Å
• α: 84.32 ± 0.02°
• β: 66.41 ± 0.02°
• γ: 71.1 ± 0.02°
• Cell volume: 1750.6 ± 0.6 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.073
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes