Information card for entry 8102968

Structure parameters

• Chemical name: niobium pentabromide
• Formula: Br5 Nb
• Calculated formula: Br5 Nb
• SMILES: [Nb]1(Br)(Br)(Br)(Br)[Br][Nb](Br)(Br)(Br)(Br)[Br]1
• Title of publication: Crystal structure of niobium pentabromide, NbBr~5~, a triclinic phase
• Authors of publication: Tragl, Sonja; Meyer, Hans-Jürgen
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2007
• Journal volume: 222
• Journal issue: 3
• Pages of publication: 161 - 162
• a: 6.4609 ± 0.0012 Å
• b: 7.0308 ± 0.0014 Å
• c: 9.584 ± 0.0017 Å
• α: 108.84 ± 0.02°
• β: 90.89 ± 0.02°
• γ: 116.16 ± 0.02°
• Cell volume: 363.38 ± 0.15 ų
• Cell temperature: 215 ± 2 K
• Ambient diffraction temperature: 215 ± 2 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No