Information card for entry 7705863

Structure parameters

• Formula: C34 H34 Li N O P2
• Calculated formula: C34 H34 Li N O P2
• Title of publication: Asymmetric bis-PNP pincer complexes of zirconium and hafnium - a measure of hemilability.
• Authors of publication: Idelson, Celia; Webster, Leah; Krämer, Tobias; Chadwick, F. Mark
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 46
• Pages of publication: 16653 - 16656
• a: 10.70733 ± 0.00003 Å
• b: 10.84431 ± 0.00003 Å
• c: 14.74442 ± 0.00003 Å
• α: 94.396 ± 0.004°
• β: 105.416 ± 0.004°
• γ: 114.647 ± 0.004°
• Cell volume: 1465.32 ± 0.07 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for all reflections: 0.1005
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.1005
• Goodness-of-fit parameter for all reflections included in the refinement: 1.459
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No