Information card for entry 4309296

Structure parameters

• Common name: Li5Ca7Sn11
• Formula: Ca7 Li5 Sn11
• Calculated formula: Ca7 Li5 Sn11
• SMILES: [Ca+2].[Sn]1[Sn][Sn][Sn][Sn]1.[Ca+2].[Ca+2].[Sn]([Sn][Sn][Sn])[Sn][Sn].[Li+].[Li+].[Ca+2].[Ca+2].[Ca+2].[Li+].[Li+].[Ca+2].[Li+]
• Title of publication: Heavy-Metal Aromatic and Conjugated Species: Rings, Oligomers, and Chains of Tin in Li9-xEuSn6+x, Li9-xCaSn6+x, Li5Ca7Sn11, Li6Eu5Sn9, LiMgEu2Sn3, and LiMgSr2Sn3
• Authors of publication: Iliya Todorov; Slavi C. Sevov
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5361 - 5369
• a: 4.6665 ± 0.001 Å
• b: 17.0592 ± 0.001 Å
• c: 31.619 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2517.1 ± 0.6 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0657
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No