Information card for entry 2004305

Structure parameters

• Chemical name: PB(REO4)2.THIOUREA
• Formula: C2 H12 N4 O26 Pb3 Re6 S2
• Calculated formula: C2 H12 N4 O26 Pb3 Re6 S2
• Title of publication: Molecular Adducts of Inorganic Salts. III. Non-Centrosymmetric 3Pb(ReO~4~)~2~.2tu.2H~2~O (tu = Thiourea)
• Authors of publication: Macícek, J.; Angelova, O.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2539 - 2542
• a: 16.208 ± 0.002 Å
• b: 16.208 ± 0.002 Å
• c: 5.8 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1523.7 ± 0.6 ų
• Cell temperature: 292 K
• Ambient diffraction temperature: 292 K
• Number of distinct elements: 7
• Space group number: 113
• Hermann-Mauguin space group symbol: P -4 21 m
• Hall space group symbol: P -4 2ab
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections: 0.132
• Weighted residual factors for significantly intense reflections: 0.049
• Goodness-of-fit parameter for all reflections: 1.946
• Goodness-of-fit parameter for significantly intense reflections: 0.736
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No