Information card for entry 2239105

Structure parameters

• Chemical name: Iodidobis(morpholine-4-carbodithioato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bismuth(III)
• Formula: C24 H28 Bi I N4 S4
• Calculated formula: C24 H28 Bi I N4 S4
• SMILES: [Bi]123(I)([n]4cccc5c4c4[n]1cccc4cc5)([S]=C(N1CCCCC1)S2)SC(=[S]3)N1CCCCC1
• Title of publication: Iodidobis(morpholine-4-carbodithioato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bismuth(III)
• Authors of publication: Li, Feng; Yin, Handong; Wu, Guoxing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 1
• Pages of publication: m20
• a: 14.782 ± 0.004 Å
• b: 10.883 ± 0.003 Å
• c: 18.03 ± 0.004 Å
• α: 90°
• β: 100.035 ± 0.004°
• γ: 90°
• Cell volume: 2856.2 ± 1.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0544
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.0999
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes