Information card for entry 7005778

Structure parameters

• Formula: C97 H137 Bi3 Cl6 N6 O2
• Calculated formula: C97 H137 Bi3 Cl6 N6 O2
• SMILES: [Bi]12([Cl][Bi]34([Cl][Bi]5([O]6CCCC6)(Cl)(N(C=[N]5c5c(cccc5C(C)C)C(C)C)c5c(cccc5C(C)C)C(C)C)[Cl]24)(N(C=[N]3c2c(cccc2C(C)C)C(C)C)c2c(cccc2C(C)C)C(C)C)Cl)([O]2CCCC2)(N(C=[N]1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)Cl.c1ccccc1C.c1cc(ccc1)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: 46.047 ± 0.009 Å
• b: 16.728 ± 0.003 Å
• c: 28.311 ± 0.006 Å
• α: 90°
• β: 112.74 ± 0.03°
• γ: 90°
• Cell volume: 20112 ± 8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0805
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.1047
• 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