Information card for entry 7042714

Structure parameters

• Formula: C34 H52 B I N4 O Zn
• Calculated formula: C34 H52 B I N4 O Zn
• Title of publication: Zinc hydridotriphenylborates suppported by a neutral macrocyclic polyamine
• Authors of publication: Okuda, Jun; Mukherjee, Debabarata; Spaniol, Thomas Paul; Wiegand, Ann-Kristin
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 16.619 ± 0.005 Å
• b: 9.831 ± 0.003 Å
• c: 21.995 ± 0.007 Å
• α: 90°
• β: 103.977 ± 0.005°
• γ: 90°
• Cell volume: 3487.2 ± 1.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0792
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.0974
• Weighted residual factors for all reflections included in the refinement: 0.1048
• Goodness-of-fit parameter for all reflections included in the refinement: 0.929
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No