Information card for entry 7023744

Structure parameters

• Chemical name: Fluorido(1,4,7,10,13,16-hexaoxacyclooctadecane)tin(II) hexafluorophosphate
• Formula: C12 H24 F7 O6 P Sn
• Calculated formula: C12 H24 F7 O6 P Sn
• SMILES: [P](F)(F)(F)(F)(F)[F-].F[Sn]1234[O]5CC[O]1CC[O]2CC[O]3CC[O]4CCOCC5
• 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: 10.676 ± 0.004 Å
• b: 10.498 ± 0.004 Å
• c: 8.533 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 956.4 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 26
• Hermann-Mauguin space group symbol: P m c 21
• Hall space group symbol: P 2c -2
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No