Information card for entry 7041321

Structure parameters

• Formula: C27 H47 B N3 O3 Si4 Zn
• Calculated formula: C27 H47 B N3 O3 Si4 Zn
• Title of publication: Unexpected alkane elimination from cationic group 13 dialkyls in a reaction with a macrocyclic polyamine.
• Authors of publication: Mukherjee, Debabrata; Spaniol, Thomas P.; Okuda, Jun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 3
• Pages of publication: 651 - 655
• a: 9.4488 ± 0.0012 Å
• b: 27.824 ± 0.004 Å
• c: 13.611 ± 0.0018 Å
• α: 90°
• β: 93.087 ± 0.002°
• γ: 90°
• Cell volume: 3573.2 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0612
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1285
• Weighted residual factors for all reflections included in the refinement: 0.1388
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No