Information card for entry 4329747

Structure parameters

• Common name: Neodymium(III) Borate Bromide
• Formula: B18 Br3 Nd4 O38
• Calculated formula: B18 Br3 Nd4 O38
• Title of publication: Effects of Large Halides on the Structures of Lanthanide(III) and Plutonium(III) Borates
• Authors of publication: Matthew J. Polinski; Shuao Wang; Justin N. Cross; Evgeny V. Alekseev; Wulf Depmeier; Thomas E. Albrecht-Schmitt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7859 - 7866
• a: 10.544 ± 0.005 Å
• b: 6.451 ± 0.003 Å
• c: 23.485 ± 0.011 Å
• α: 90°
• β: 97.754 ± 0.005°
• γ: 90°
• Cell volume: 1582.8 ± 1.3 ų
• Cell temperature: 127 ± 2 K
• Ambient diffraction temperature: 127 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No