Information card for entry 1514913

Structure parameters

• Formula: C27 H19 Cl O3 Sn
• Calculated formula: C27 H19 Cl O3 Sn
• SMILES: [Sn]1(Cl)([O]=C2C(O1)=C(Oc1c2cccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Selective fluorometric detection of pyrophosphate by 3-hydroxyflavone-diphenyltin(IV) complex in aqueous micellar medium.
• Authors of publication: Villamil-Ramos, Raul; Barba, Víctor; Yatsimirsky, Anatoly K.
• Journal of publication: The Analyst
• Year of publication: 2012
• Journal volume: 137
• Journal issue: 22
• Pages of publication: 5229 - 5236
• a: 9.582 ± 0.004 Å
• b: 10.189 ± 0.005 Å
• c: 12.743 ± 0.006 Å
• α: 80.315 ± 0.007°
• β: 81.682 ± 0.007°
• γ: 72.174 ± 0.007°
• Cell volume: 1161.7 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1215
• Residual factor for significantly intense reflections: 0.0999
• Weighted residual factors for significantly intense reflections: 0.1787
• Weighted residual factors for all reflections included in the refinement: 0.186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.366
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No