Information card for entry 7204867

Structure parameters

• Common name: syn-7-trimethyl-silyl-5 Norbornene-2,3-endo -dicarboxylic acid
• Formula: C12 H18 O4 Si
• Calculated formula: C12 H18 O4 Si
• SMILES: [Si](C1[C@@H]2[C@H]([C@H]([C@H]1C=C2)C(=O)O)C(=O)O)(C)(C)C
• Title of publication: The influence of the trimethylsilyl group: helical self-assembly of syn-7-trimethylsilyl-5-norbornene-endo-2,3-dicarboxylic acid
• Authors of publication: Shahina Begum, Noor; Girija, C. R.; Nagendrappa, Gopalpur
• Journal of publication: CrystEngComm
• Year of publication: 2004
• Journal volume: 6
• Journal issue: 24
• Pages of publication: 116
• a: 22.5962 ± 0.0005 Å
• b: 8.1506 ± 0.0002 Å
• c: 7.6964 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1417.47 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.1103
• Weighted residual factors for all reflections included in the refinement: 0.1133
• Goodness-of-fit parameter for all reflections included in the refinement: 0.89
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No