Information card for entry 7110623

Structure parameters

• Common name: Dodecakis(N,N-diisopropylcarbamato)tetraneodimium(iii)
• Formula: C100 H194 N12 Nd4 O24
• Calculated formula: C100 H168 N12 Nd4 O24
• Title of publication: Isotypical N,N-dialkylcarbamato lanthanide complexes covering a range of 11 atomic numbers: direct experimental assessment of the lanthanide contraction in trivalent molecular compounds
• Authors of publication: Abram, Ulrich; Dell’Amico, Daniela Belli; Calderazzo, Fausto; Porta, Cinzia Della; Merigo, Alessandra; Englert, Ulli; Marchetti, Fabio
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 20
• Pages of publication: 2053
• a: 28.97 ± 0.01 Å
• b: 20.064 ± 0.008 Å
• c: 23.549 ± 0.009 Å
• α: 90°
• β: 107.44 ± 0.04°
• γ: 90°
• Cell volume: 13059 ± 9 ų
• Cell temperature: 253 K
• Ambient diffraction temperature: 253 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1879
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for all reflections: 0.1792
• Weighted residual factors for significantly intense reflections: 0.1563
• Goodness-of-fit parameter for all reflections: 0.896
• Goodness-of-fit parameter for significantly intense reflections: 1.2
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No