Information card for entry 7017597

Structure parameters

• Formula: C18 H64 B20 Cl2 N2 Sn4
• Calculated formula: C18 H64 B20 Cl2 N2 Sn4
• SMILES: [Sn]1234([Sn]567[BH]891[BH]1%106[BH]6%117[BH]725[BH]254[BH]438[BH]391[BH]154[BH]672[BH]%10%1131)C[Sn]1234[Sn]567[BH]891[BH]1%106[BH]6%117[BH]725[BH]253[BH]348[BH]485[BH]672[BH]1%114[BH]9%1038.[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC.C(Cl)Cl
• Title of publication: 1,2-Distanna-closo-dodecaborate‒a rare example of a 1,2-distannylene ligand in transition metal chemistry.
• Authors of publication: Nickl, Claudia; Eichele, Klaus; Wesemann, Lars
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 1
• Pages of publication: 243 - 250
• a: 8.5534 ± 0.0007 Å
• b: 15.7761 ± 0.0012 Å
• c: 16.573 ± 0.0013 Å
• α: 90.417 ± 0.006°
• β: 101.725 ± 0.006°
• γ: 104.461 ± 0.006°
• Cell volume: 2116.3 ± 0.3 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: 0.041
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0525
• Weighted residual factors for all reflections included in the refinement: 0.0549
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No