Information card for entry 7005776

Structure parameters

• Formula: C57 H69 Bi N6
• Calculated formula: C57 H69 Bi N6
• SMILES: [Bi]123(N(c7c(cc(cc7C)C)C)C=[N]1c1c(cc(cc1C)C)C)(N(c1c(cc(cc1C)C)C)C=[N]2c1c(cc(cc1C)C)C)N(c1c(cc(cc1C)C)C)C=[N]3c1c(cc(cc1C)C)C
• 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: 25.183 ± 0.0002 Å
• b: 12.6656 ± 0.0002 Å
• c: 16.4914 ± 0.0004 Å
• α: 90°
• β: 104.166 ± 0.001°
• γ: 90°
• Cell volume: 5100.11 ± 0.15 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• 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: 0.0471
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No