Information card for entry 7005775

Structure parameters

• Formula: C130 H172 Bi2 N12 O
• Calculated formula: C130 H172 Bi2 N12 O
• SMILES: [Bi]123(N(c4c(cccc4CC)CC)C=[N]2c2c(cccc2CC)CC)(N(c2c(cccc2CC)CC)C=[N]1c1c(cccc1CC)CC)N(c1c(cccc1CC)CC)C=[N]3c1c(cccc1CC)CC.O(CC)CC
• Title of publication: Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.
• Authors of publication: Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 30
• Pages of publication: 3282 - 3288
• a: 14.505 ± 0.003 Å
• b: 38.248 ± 0.008 Å
• c: 22.094 ± 0.004 Å
• α: 90°
• β: 108.64 ± 0.03°
• γ: 90°
• Cell volume: 11615 ± 5 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0839
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.0873
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No