Information card for entry 7219400

Structure parameters

• Formula: C28 H38 Bi Cl5 N2 Se
• Calculated formula: C28 H38 Bi Cl5 N2 Se
• Title of publication: Heavier chalcogenone complexes of bismuth(III)trihalides: Potential catalysts for acylative cleavage of cyclic ethers
• Authors of publication: Katam, Srinivas; Suresh, Paladugu; Chatla, Naga Babu; Arruri, Sathyanarayana; Ganesan, Prabusankar
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 10.75451 ± 0.00016 Å
• b: 16.0772 ± 0.0002 Å
• c: 19.7995 ± 0.0004 Å
• α: 90°
• β: 104.683 ± 0.0016°
• γ: 90°
• Cell volume: 3311.58 ± 0.1 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.041741
• Residual factor for significantly intense reflections: 0.038398
• Weighted residual factors for all reflections included in the refinement: 0.106819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04093
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No