Information card for entry 4076925

Structure parameters

• Common name: 1,2-trans-2,3-trans-4,5,6,7-Tetrachloro-1-(2,3,4,5-tetrachlorophenyl) -2-trimethylsilyl-3-(trimethylsilylmethyl)indane
• Chemical name: 1,2-trans-2,3-trans-4,5,6,7-Tetrachloro-1-(2,3,4,5-tetrachlorophenyl) -2-trimethylsilyl-3-(trimethylsilylmethyl)indane
• Formula: C22 H24 Cl8 Si2
• Calculated formula: C22 H24 Cl8 Si2
• SMILES: [Si](C[C@@H]1[C@@H]([Si](C)(C)C)[C@@H](c2c(Cl)c(Cl)c(Cl)c(Cl)c12)c1c(Cl)c(Cl)c(Cl)c(Cl)c1)(C)(C)C.[Si](C[C@H]1[C@H]([Si](C)(C)C)[C@H](c2c(Cl)c(Cl)c(Cl)c(Cl)c12)c1c(Cl)c(Cl)c(Cl)c(Cl)c1)(C)(C)C
• Title of publication: Friedel−Crafts Alkylation of Polychlorobenzenes with (1,2-Dichloroethyl)trichlorosilane
• Authors of publication: Han, Joon Soo; Lim, Weon Cheol; Yoo, Bok Ryul; Jin, Jung-Il; Jung, Il Nam
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 18
• Pages of publication: 3803
• a: 8.9103 ± 0.0002 Å
• b: 12.427 Å
• c: 13.7735 ± 0.0001 Å
• α: 81.629 ± 0.001°
• β: 84.5 ± 0.001°
• γ: 76.363 ± 0.001°
• Cell volume: 1463.33 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.074
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1262
• Weighted residual factors for all reflections included in the refinement: 0.1391
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No