Information card for entry 1551701

Structure parameters

• Formula: C5 H16 Bi Br5 N2
• Calculated formula: C5 H16 Bi Br5 N2
• Title of publication: Synthesis and Crystal Structure of Penthylenediammonium pentabromobismutate(III) [NH3(CH2)5NH3]BiBr5
• Authors of publication: OULED MOHAMED SGHAIER, Mohsen; ABDELHEDI, Mohamed; CHAABOUNI, Slaheddine
• Journal of publication: X-ray Structure Analysis Online
• Year of publication: 2012
• Journal volume: 28
• Pages of publication: 1
• a: 7.958 ± 0.0004 Å
• b: 14.011 ± 0.0016 Å
• c: 14.096 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1571.7 ± 0.3 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for all reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.0547
• Weighted residual factors for all reflections included in the refinement: 0.0547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1721
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No