Information card for entry 7036625

Structure parameters

• Formula: C28 H23 Ag F6 N3 O9 Re S5
• Calculated formula: C28 H23 Ag F6 N3 O9 Re S5
• Title of publication: Re(i) derivatives functionalised with thioether crowns containing the 1,10-phenanthroline subunit as a new class of chemosensors.
• Authors of publication: Casula, Arianna; Nairi, Valentina; Fernández-Moreira, Vanesa; Laguna, Antonio; Lippolis, Vito; Garau, Alessandra; Gimeno, M Concepción
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 42
• Pages of publication: 18506 - 18517
• a: 8.0661 ± 0.0016 Å
• b: 14.506 ± 0.003 Å
• c: 16.119 ± 0.003 Å
• α: 95.31 ± 0.03°
• β: 93.94 ± 0.03°
• γ: 101.67 ± 0.03°
• Cell volume: 1831.7 ± 0.7 ų
• Cell temperature: 546 ± 2 K
• Ambient diffraction temperature: 546 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.11
• Residual factor for significantly intense reflections: 0.0793
• Weighted residual factors for significantly intense reflections: 0.1886
• Weighted residual factors for all reflections included in the refinement: 0.2084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No