Information card for entry 7251492

Structure parameters

• Formula: C8 H18 O13 Pb Re2
• Calculated formula: C8 H18 O13 Pb Re2
• Title of publication: The first lead perrhenate crown ether complex [Pb(12-crown-4)(H2O)(ReO4)2]: from rotation of the ReO4 tetrahedra in the (3 + 1)D space using constrained Legendre functions to rotation in the 3D space
• Authors of publication: Charkin, Dmitri; Grishaev, Vasili; Kireev, Vadim; Volkov, Sergey; Arsent'ev, Maxim; Vorobiev, Stepan; Gosteva, Alevtina; Kompanchenko, Alena; Khasanov, Kirill; Krzhizhanovskaya, Maria; Aksenov, Sergey; Petříček, Václav
• Journal of publication: CrystEngComm
• Year of publication: 2026
• Journal volume: 28
• Journal issue: 5
• Pages of publication: 1000 - 1007
• a: 7.9684 ± 0.0003 Å
• b: 28.1002 ± 0.0013 Å
• c: 7.9792 ± 0.0004 Å
• α: 90°
• β: 100.755 ± 0.003°
• γ: 90°
• Cell volume: 1755.27 ± 0.14 ų
• Cell temperature: 295.66 K
• Ambient diffraction temperature: 295.66 K
• Number of distinct elements: 5
• 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: 0.0688
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0374
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for significantly intense reflections: 1.8052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.6408
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No