Information card for entry 7035157

Structure parameters

• Formula: C79 H115 B2 N4 Nd2 O4
• Calculated formula: C79 H115 B2 N4 Nd2 O4
• Title of publication: Bis(phenolate)amine-supported lanthanide borohydride complexes for styrene and trans-1,4-isoprene (co-)polymerisations.
• Authors of publication: Bonnet, Fanny; Dyer, Hellen E.; El Kinani, Yassine; Dietz, Carin; Roussel, Pascal; Bria, Marc; Visseaux, Marc; Zinck, Philippe; Mountford, Philip
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 27
• Pages of publication: 12312 - 12325
• a: 10.9086 ± 0.0002 Å
• b: 12.4311 ± 0.0003 Å
• c: 14.3552 ± 0.0003 Å
• α: 82.603 ± 0.001°
• β: 86.468 ± 0.002°
• γ: 87.025 ± 0.001°
• Cell volume: 1924.88 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0579
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.0356
• Weighted residual factors for all reflections included in the refinement: 0.0343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1176
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No