Information card for entry 7204696

Structure parameters

• Formula: C27 H54 Bi N3 Se6
• Calculated formula: C27 H54 Bi N3 Se6
• Title of publication: Aerosol-assisted metallo-organic chemical vapour deposition of Bi2Se3 films using single-molecule precursors. The crystal structure of bismuth(iii) dibutyldiselenocarbamate
• Authors of publication: Monteiro, Olinda C.; Trindade, Tito; Paz, Filipe A. Almeida; Klinowski, Jacek; Waters, John; O'Brien, Paul
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2003
• Journal volume: 13
• Journal issue: 12
• Pages of publication: 3006
• a: 11.3962 ± 0.0001 Å
• b: 11.9752 ± 0.0001 Å
• c: 28.0596 ± 0.0004 Å
• α: 81.8236 ± 0.0005°
• β: 86.7661 ± 0.0004°
• γ: 86.6659 ± 0.0008°
• Cell volume: 3779.51 ± 0.07 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0867
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1477
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No