Information card for entry 7000066

Structure parameters

• Common name: Compound 9
• Formula: C24 H20 Cl2 Ga N P2 Se2
• Calculated formula: C24 H20 Cl2 Ga N P2 Se2
• SMILES: [Se]1[Ga]2([Se]P(c3ccccc3)(c3ccccc3)=N[P+]1(c1ccccc1)c1ccccc1)[Se]P(c1ccccc1)(=N[P+]([Se]2)(c1ccccc1)c1ccccc1)c1ccccc1.[Ga](Cl)(Cl)(Cl)[Cl-]
• Title of publication: Dichloro and alkylchloro gallium derivatives of dichalcogenoimidodiphosphinate ligands: isolation of a spirogallium cation.
• Authors of publication: Muñoz-Hernández, Miguel-Angel; Montiel-Palma, Virginia; Huitrón-Rattinger, Estefanía; Cortés-Llamas, Sara; Tiempos-Flores, Norma; Grevy, Jean-Michel; Silvestru, Cristian; Power, Philip
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 1
• Pages of publication: 193 - 199
• a: 14.544 ± 0.002 Å
• b: 15.672 ± 0.002 Å
• c: 24.498 ± 0.003 Å
• α: 89.897 ± 0.003°
• β: 89.963 ± 0.003°
• γ: 70.891 ± 0.003°
• Cell volume: 5276.2 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0656
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No