Information card for entry 7031692

Structure parameters

• Formula: C32 H26 Bi2 N18 S4
• Calculated formula: C32 H26 Bi2 N18 S4
• Title of publication: Boron-centered soft ligands based on tetrazole units and their complexes with sodium, potassium and bismuth ions.
• Authors of publication: Imran, Muhammad; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Monkowius, Uwe; Bleckenwegner, Petra; Mitzel, Norbert W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 39
• Pages of publication: 14737 - 14748
• a: 7.07185 ± 0.00017 Å
• b: 11.5039 ± 0.0004 Å
• c: 13.7591 ± 0.0005 Å
• α: 67.741 ± 0.003°
• β: 89.501 ± 0.002°
• γ: 78.825 ± 0.002°
• Cell volume: 1013.72 ± 0.06 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0278
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0647
• Weighted residual factors for all reflections included in the refinement: 0.0656
• Goodness-of-fit parameter for all reflections included in the refinement: 1.158
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No