Information card for entry 4066444

Structure parameters

• Common name: JY-173X
• Chemical name: tilley03
• Formula: C25 H19 Cl4 N2 Ni Si
• Calculated formula: C25 H19 Cl4 N2 Ni Si
• SMILES: c1ccc2cccc3c2[n]1[Ni]12([C]4(C=CC=C[CH]1=4)[Si]3(c1cccc3ccc[n]2c13)Cl)Cl.C(Cl)Cl
• Title of publication: Nickel Complexes with Bis(8-quinolyl)silyl Ligands. An Unusual Ni3Si2Cluster Containing Six-Coordinate Silicon†
• Authors of publication: Yang, Jian; Del Rosal, Iker; Fasulo, Meg; Sangtrirutnugul, Preeyanuch; Maron, Laurent; Tilley, T. Don
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 21
• Pages of publication: 5544
• a: 14.9511 ± 0.0007 Å
• b: 10.0728 ± 0.0005 Å
• c: 15.782 ± 0.0007 Å
• α: 90°
• β: 97.116 ± 0.003°
• γ: 90°
• Cell volume: 2358.45 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.051
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1116
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No