Information card for entry 2201657

Structure parameters

• Chemical name: Bis(aquachlorodimethylphenyltin)^.^18-crown-6
• Formula: C28 H50 Cl2 O8 Sn2
• Calculated formula: C28 H50 Cl2 O8 Sn2
• SMILES: C[Sn](C)(c1ccccc1)(Cl)[OH2].C1OCCOCCOCCOCCOCCOC1.C[Sn](C)(c1ccccc1)(Cl)[OH2]
• Title of publication: Aquachlorodimethylphenyltin‒18-crown-6 (2/1)
• Authors of publication: Amini, Mostafa M.; Azadmehr, Amirreza; Hossein Abadi, Shabnam; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: m484 - m485
• a: 9.6395 ± 0.0006 Å
• b: 19.472 ± 0.001 Å
• c: 10.511 ± 0.0007 Å
• α: 90°
• β: 116.015 ± 0.001°
• γ: 90°
• Cell volume: 1773.02 ± 0.19 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.097
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.107
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes