Information card for entry 7038827

Structure parameters

• Common name: tBu-BPin-Salph-Ni
• Chemical name: N-(5-tert-Butylsalicyliden)-N'-(5-pinacolboronylsalicyliden)-phenylendiaminatonickel(II)
• Formula: C30 H33 B N2 Ni O4
• Calculated formula: C30 H33 B N2 Ni O4
• Title of publication: Direct C-C coupling of two Ni-salphen complexes to yield dinickel-disalphen complexes with symmetric and non-symmetric substitution-patterns.
• Authors of publication: Bugenhagen, B. E. C.; Prosenc, M. H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 17
• Pages of publication: 7460 - 7468
• a: 15.4727 ± 0.0004 Å
• b: 13.78428 ± 0.00017 Å
• c: 14.1565 ± 0.0003 Å
• α: 90°
• β: 114.416 ± 0.003°
• γ: 90°
• Cell volume: 2749.28 ± 0.12 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0536
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.116
• Weighted residual factors for all reflections included in the refinement: 0.1202
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No