Information card for entry 4028827

Structure parameters

• Chemical name: (<i>E</i>)-1-((<i>tert</i>-butyldimethylsilyl)methylene) -2-(2,4-dinitrophenyl)hydrazine
• Formula: C13 H20 N4 O4 Si
• Calculated formula: C13 H20 N4 O4 Si
• SMILES: C[Si](C(C)(C)C)(C)/C=N/Nc1c(N(=O)=O)cc(N(=O)=O)cc1
• Title of publication: Synthesis of Formylsilanes through Oxidative Cleavage of α-Silyl Glycols
• Authors of publication: Henrik von Wachenfeldt; Daniel Strand
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2013
• Journal volume: 78
• Pages of publication: 12268 - 12273
• a: 7.2895 ± 0.0007 Å
• b: 7.8258 ± 0.0014 Å
• c: 16.3446 ± 0.0016 Å
• α: 85.433 ± 0.011°
• β: 83.772 ± 0.008°
• γ: 89.605 ± 0.01°
• Cell volume: 923.9 ± 0.2 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: 0.2076
• Residual factor for significantly intense reflections: 0.1399
• Weighted residual factors for significantly intense reflections: 0.3171
• Weighted residual factors for all reflections included in the refinement: 0.3382
• Goodness-of-fit parameter for all reflections included in the refinement: 2.802
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No