Information card for entry 7007206

Structure parameters

• Common name: (Cd(9S3)2)(PF6)2
• Formula: C14 H30 Cd F12 N2 O4 P2 S6
• Calculated formula: C14 H30 Cd F12 N2 O4 P2 S6
• Title of publication: Cadmium-113 NMR studies on homoleptic complexes containing thioether ligands: the crystal structures of [Cd([12]aneS4)2](ClO4)2, [Cd([18]aneS4N2)](PF6)2 and [Cd([9]aneS3)2](PF6)2.
• Authors of publication: Helm, Monte L.; Hill, Lensey L.; Lee, John P.; Van Derveer, Donald G.; Grant, Gregory J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 29
• Pages of publication: 3534 - 3543
• a: 8.18 ± 0.003 Å
• b: 10.089 ± 0.003 Å
• c: 10.129 ± 0.004 Å
• α: 82.599 ± 0.005°
• β: 66.62 ± 0.005°
• γ: 89.569 ± 0.005°
• Cell volume: 760 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0444
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1136
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No