Information card for entry 4072602

Structure parameters

• Chemical name: Pyrrole-2-N-(o-hydroxyphenyl)-carbaldimine
• Formula: C11 H10 N2 O
• Calculated formula: C11 H10 N2 O
• SMILES: Oc1c(/N=C/c2[nH]ccc2)cccc1
• 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: 28.2723 ± 0.0014 Å
• b: 4.7091 ± 0.0002 Å
• c: 17.1055 ± 0.0009 Å
• α: 90°
• β: 125.333 ± 0.002°
• γ: 90°
• Cell volume: 1857.89 ± 0.16 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0669
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.106
• Weighted residual factors for all reflections included in the refinement: 0.1147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No