Information card for entry 7702206

Structure parameters

• Formula: C33 H42 B N3 O2
• Calculated formula: C33 H42 B N3 O2
• Title of publication: Dinuclear tethered pyridine, diimine complexes.
• Authors of publication: Dammann, Wiebke; Buban, Tabea; Schiller, Carl; Burger, Peter
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 35
• Pages of publication: 12105 - 12117
• a: 11.5588 ± 0.0004 Å
• b: 10.175 ± 0.0003 Å
• c: 26.5199 ± 0.0009 Å
• α: 90°
• β: 91.946 ± 0.001°
• γ: 90°
• Cell volume: 3117.23 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0997
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.2306
• Weighted residual factors for all reflections included in the refinement: 0.2396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No