Information card for entry 7003233

Structure parameters

• Common name: Sm(O2N_Pr)(HO2N_Pr) . 0.825 (C5 H12)
• Chemical name: Sm(O2N_Pr)(HO2N_Pr) . 0.825 (C5 H12)
• Formula: C70.125 H112.9 N2 O4 Sm
• Calculated formula: C70.125 H112.9 N2 O4 Sm
• Title of publication: Zwitterionic bis(phenolate)amine lanthanide complexes for the ring-opening polymerisation of cyclic esters
• Authors of publication: Dyer, Hellen E.; Huijser, Saskia; Schwarz, Andrew D.; Wang, Chao; Duchateau, Robbert; Mountford, Philip
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 1
• Pages of publication: 32
• a: 24.9701 ± 0.0002 Å
• b: 19.7923 ± 0.0002 Å
• c: 31.0532 ± 0.0003 Å
• α: 90°
• β: 106.523 ± 0.0003°
• γ: 90°
• Cell volume: 14713.3 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• 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: 0.1251
• Residual factor for significantly intense reflections: 0.0825
• Weighted residual factors for all reflections: 0.1269
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9471
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No