Information card for entry 4123226

Structure parameters

• Common name: 6
• Formula: C36 H58 N5 Si4 Y
• Calculated formula: C36 H58 N5 Si4 Y
• SMILES: [Y]1(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)(N(Cc2ccccc2)Cc2ccccc2)[n]2ccccc2c2[n]1cccc2
• Title of publication: Aminomethylation Reaction of ortho-Pyridyl C-H Bonds Catalyzed by Group 3 Metal Triamido Complexes.
• Authors of publication: Nagae, Haruki; Shibata, Yu; Tsurugi, Hayato; Mashima, Kazushi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 2
• Pages of publication: 640 - 643
• a: 25.749 ± 0.013 Å
• b: 12.001 ± 0.006 Å
• c: 27.085 ± 0.014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8370 ± 7 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0789
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1027
• Weighted residual factors for all reflections included in the refinement: 0.1159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No