Information card for entry 7023745

Structure parameters

• Chemical name: Bis(diaqua(1,4,10,13-tetraoxa-7,16-dithiacyclooctadecane)tin(II)) tris-hexafluorophosphate fluoride
• Formula: C24 H56 F19 O12 P3 S4 Sn2
• Calculated formula: C24 H48 F19 O12 P3 S4 Sn2
• Title of publication: Oxa-thia-, oxa-selena and crown ether macrocyclic complexes of tin(ii) tetrafluoroborate and hexafluorophosphate - synthesis, properties and structures.
• Authors of publication: Beattie, Christopher; Farina, Paolo; Levason, William; Reid, Gillian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 42
• Pages of publication: 15183 - 15190
• a: 17.656 ± 0.003 Å
• b: 17.656 ± 0.003 Å
• c: 15.5791 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4856.5 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 130
• Hermann-Mauguin space group symbol: P 4/n c c :2
• Hall space group symbol: -P 4a 2ac
• Residual factor for all reflections: 0.0593
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1283
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No