Information card for entry 7009295

Structure parameters

• Formula: C5 H12 Bi Br3 Se2
• Calculated formula: C5 H12 Bi Br3 Se2
• Title of publication: Synthesis and structures of bismuth(III) complexes involving thio- and seleno-ether ligands
• Authors of publication: Barton, Andrew J.; Genge, Anthony R. J.; Levason, William; Reid, Gillian
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 6
• Pages of publication: 859
• a: 13.013 ± 0.002 Å
• b: 12.012 ± 0.002 Å
• c: 18.305 ± 0.004 Å
• α: 90°
• β: 103.64 ± 0.02°
• γ: 90°
• Cell volume: 2780.6 ± 0.9 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 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 significantly intense reflections: 0.036
• Weighted residual factors for all reflections included in the refinement: 0.0382
• Goodness-of-fit parameter for all reflections included in the refinement: 1.657
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No