Information card for entry 2241373

Structure parameters

• Common name: sjfbk49
• Chemical name: Tris[1-oxopyridine-2-olato(1-)]silicon(IV) chloride acetonitrile unknown solvate
• Formula: C15 H12 Cl N3 O6 Si
• Calculated formula: C15 H12 Cl N3 O6 Si
• Title of publication: Crystal structures of tris[1-oxopyridine-2-olato(1{-})]silicon(IV) chloride chloroform-<i>d</i>~1~ disolvate, tris[1-oxopyridine-2-olato(1{-})]silicon(IV) chloride acetonitrile unquantified solvate, and <i>fac</i>-tris[1-oxopyridine-2-thiolato(1{-})]silicon(IV) chloride chloroform-<i>d</i>~1~ disolvate
• Authors of publication: Kraft, Bradley M.; Brennessel, William W.; Ryan, Amy E.; Benjamin, Candace K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: 1531 - 1535
• a: 6.8347 ± 0.0007 Å
• b: 11.1232 ± 0.0012 Å
• c: 13.1513 ± 0.0014 Å
• α: 90.479 ± 0.002°
• β: 93.269 ± 0.002°
• γ: 102.356 ± 0.002°
• Cell volume: 974.85 ± 0.18 ų
• Cell temperature: 100 ± 0.5 K
• Ambient diffraction temperature: 100 ± 0.5 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1185
• Weighted residual factors for all reflections included in the refinement: 0.1321
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes