Information card for entry 1506302

Structure parameters

• Common name: 2,4,5,7-tetramethoxynaphthaldehyde
• Chemical name: 2,4,5,7-tetramethoxynaphthaldehyde
• Formula: C15 H16 O5
• Calculated formula: C15 H16 O5
• SMILES: O(c1c(c2cc(cc(c2c(OC)c1)OC)OC)C=O)C
• Title of publication: Carbocations in action. Design, synthesis, and evaluation of a highly acid-sensitive naphthalene-based backbone amide linker for solid-phase synthesis.
• Authors of publication: Pittelkow, Michael; Boas, Ulrik; Christensen, Jørn B
• Journal of publication: Organic letters
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 25
• Pages of publication: 5817 - 5820
• a: 8.193 ± 0.0007 Å
• b: 8.974 ± 0.0009 Å
• c: 18.504 ± 0.0013 Å
• α: 89.169 ± 0.008°
• β: 81.157 ± 0.006°
• γ: 72.754 ± 0.008°
• Cell volume: 1283.2 ± 0.2 ų
• Cell temperature: 122 ± 2 K
• Ambient diffraction temperature: 122 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0487
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No