Information card for entry 4328462

Structure parameters

• Chemical name: 1-chloro-1,5-diselenocan-1-ium tetrachlorogallate(III) dichloromethane solvate
• Formula: C7 H14 Cl7 Ga Se2
• Calculated formula: C7 H14 Cl7 Ga Se2
• SMILES: [Ga](Cl)(Cl)([Cl-])Cl.Cl[Se]12[Se+](CCC1)CCC2.ClCCl
• Title of publication: Unexpected Reactivity and Coordination in Gallium(III) and Indium(III) Chloride Complexes With Geometrically Constrained Thio- and Selenoether Ligands
• Authors of publication: Kathryn George; Marek Jura; William Levason; Mark E. Light; Luke P. Ollivere; Gillian Reid
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 2231 - 2240
• a: 7.3566 ± 0.001 Å
• b: 12.521 ± 0.002 Å
• c: 18.67 ± 0.003 Å
• α: 90°
• β: 93.107 ± 0.01°
• γ: 90°
• Cell volume: 1717.2 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.0486
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No