Information card for entry 2201346

Structure parameters

• Formula: C4 H8 Cl3 Ga O
• Calculated formula: C4 H8 Cl3 Ga O
• SMILES: C1[O]([Ga](Cl)(Cl)Cl)CCC1
• Title of publication: Trichloro(tetrahydrofuran)gallium(III)
• Authors of publication: Scholz, Stefan; Lerner, Hans-Wolfram; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 10
• Pages of publication: m586 - m587
• a: 6.2048 ± 0.0009 Å
• b: 10.398 ± 0.0011 Å
• c: 7.3089 ± 0.001 Å
• α: 90°
• β: 106.085 ± 0.011°
• γ: 90°
• Cell volume: 453.09 ± 0.11 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0406
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes