98170-47-9

Basic information

• Product Name: NiCl(CH₂C₆H₄CH₃)(CNC(CH₃)3)4
• CAS NO: 98170-47-9
• Molecular Weight: 531.835
• Mol File: 98170-47-9.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: NiCl(CH₂C₆H₄CH₃)(CNC(CH₃)3)4(CAS DataBase Reference)
• NIST Chemistry Reference: NiCl(CH₂C₆H₄CH₃)(CNC(CH₃)3)4(98170-47-9)
• EPA Substance Registry System: NiCl(CH₂C₆H₄CH₃)(CNC(CH₃)3)4(98170-47-9)

Safety Data

• Hazardous Substances Data: 98170-47-9(Hazardous Substances Data)

Upstream product

• 29875-05-6 2-methylbenzylmagnesium chloride 
• 552-45-4 1-chloromethyl-2-methylbenzene 
• 98170-37-7 NiCl(CH₂C₆H₄CH₃)(P(CH₃)3) 
• 119072-55-8 tert-butylisonitrile 

Relevant articles and documents

New nickel o-xylyl complexes. Crystal and molecular structure of Ni3(CH2C6H4Me-o) 4(PMe3)2(μ3-OH)2

The formation of the new nickel o-xylyl derivatives NiCl(η1-CH2C6H4CH 3)(PMe3)2, 1, NiCl(η3-CH2C6H4CH 3)(PMe3), 2, and Ni3(η1-CH2C6H4CH 3)4(PMe3)2-(μ 3-OH)2, 3, is reported. A crystal structure determination on 3 shows the complex crystallizes in the space group P1 with a = 10.428 (2) A?, b = 12.646 (3) A?, c = 16.551 (3) A?, α = 70.68 (2)°, β = 79.54 (1)°, γ = 69.20 (2)°, V = 1920.4 A?3, and Z = 2. The molecule possesses a distorted trigonal-bipyramidal Ni3(OH)2 core with the Ni(II) ions in a distorted square-planar environment. Apart from the hydroxo ions, the coordination sphere of the nickel(II) ions is completed by two o-xylyl groups for one of the Ni(II) and by one alkyl group and one PMe3 ligand for the others.