Information card for entry 2201662

Structure parameters

• Chemical name: [bis(dicyclohexylphosphino)ethane-κ^2^P,P']bromo(phenyl)nickel(II) chlorobenzene solvate
• Formula: C38 H58 Br Cl Ni P2
• Calculated formula: C38 H58 Br Cl Ni P2
• SMILES: [Ni]1(Br)([P](CC[P]1(C1CCCCC1)C1CCCCC1)(C1CCCCC1)C1CCCCC1)c1ccccc1.Clc1ccccc1
• Title of publication: The nickel(II) complex [NiBr(Ph){(C~6~H~11~)~2~P(CH~2~)~2~P(C~6~H~11~)~2~}]·PhCl
• Authors of publication: Alison J. Edwards; Mikael Retbøll; Eric Wenger
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: m497 - m499
• a: 11.8308 ± 0.0001 Å
• b: 22.779 ± 0.0003 Å
• c: 14.5238 ± 0.0002 Å
• α: 90°
• β: 107.407 ± 0.0005°
• γ: 90°
• Cell volume: 3734.82 ± 0.08 ų
• Cell temperature: 200 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for all reflections included in the refinement: 0.0305
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0463
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes