Information card for entry 7037271

Structure parameters

• Formula: C2 H10 K4 N2 O Pb Se4
• Calculated formula: C2 H10 K4 N2 O Pb Se4
• Title of publication: Smallest molecular chalcogenidometalate anions of the heaviest metals: syntheses, structures, and their interconversion.
• Authors of publication: Thiele, G.; Donsbach, C.; Riedel, R.; Marsch, M.; Harms, K.; Dehnen, S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 5958 - 5967
• a: 8.0377 ± 0.0005 Å
• b: 8.1958 ± 0.0005 Å
• c: 12.6944 ± 0.0007 Å
• α: 92.602 ± 0.002°
• β: 102.77 ± 0.002°
• γ: 93.193 ± 0.002°
• Cell volume: 812.87 ± 0.08 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0198
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0402
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No