Information card for entry 4072603

Structure parameters

• Chemical name: Pyrrole-2-N-(o-oxyphenyl)-carbaldiminato-silacyclobutane
• Formula: C14 H14 N2 O Si
• Calculated formula: C14 H14 N2 O Si
• SMILES: [Si]123(Oc4c([N]2=Cc2n1ccc2)cccc4)CCC3
• Title of publication: Dianion of Pyrrole-2-N-(o-hydroxyphenyl)carbaldimine as an Interesting Tridentate (ONN) Ligand System in Hypercoordinate Silicon Complexes
• Authors of publication: Gerlach, Daniela; Brendler, Erica; Heine, Thomas; Wagler, Jörg
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 1
• Pages of publication: 234
• a: 5.9727 ± 0.0005 Å
• b: 25.413 ± 0.003 Å
• c: 8.2155 ± 0.0008 Å
• α: 90°
• β: 90.328 ± 0.003°
• γ: 90°
• Cell volume: 1247 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0471
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No