Information card for entry 7204793

Structure parameters

• Formula: C36 H12 Bi F15 N6 S3
• Calculated formula: C36 H12 Bi F15 N6 S3
• SMILES: [Bi](Sc1c(c(c(c(c1F)F)F)F)F)(Sc1c(c(c(c(c1F)F)F)F)F)(Sc1c(c(c(c(c1F)F)F)F)F)[n]1ccc(cc1)c1nc(c2ccncc2)nc(c2ccncc2)n1
• Title of publication: Coordination polymers formed by Bi(SC6F5)3 with multidentate polypyridyl ligands
• Authors of publication: Charmant, Jonathan P. H.; Jahan, A. H. M. Monowar; Norman, Nicholas C.; Orpen, A. Guy; Podesta, Thomas J.
• Journal of publication: CrystEngComm
• Year of publication: 2004
• Journal volume: 6
• Journal issue: 7
• Pages of publication: 29
• a: 7.5887 ± 0.0018 Å
• b: 14.181 ± 0.006 Å
• c: 17.931 ± 0.005 Å
• α: 73.275 ± 0.013°
• β: 78.66 ± 0.02°
• γ: 75.19 ± 0.02°
• Cell volume: 1770.8 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0894
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.1313
• Weighted residual factors for all reflections included in the refinement: 0.1461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No