nickel(2+); tris(2-methylphenyl) phosphite

Systemtic Name: nickel(2+); tris(2-methylphenyl) phosphite Openeye Name: nickelous tris-o-tolyl phosphite CAS Name: nickel(2+); phosphorous acid tris(2-methylphenyl) ester IUPAC Name: nickel(2+); tris(2-methylphenyl) phosphite Traditional Name: nickelous phosphorous acid tris-o-tolyl ester Formula: C84H84NiO12P4+2 MolecularWeight: 1468.147004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.[Ni+2]

Isomeric SMILES

CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C.[Ni+2]

InChI

InChI=1S/4C21H21O3P.Ni/c4*1-16-10-4-7-13-19(16)22-25(23-20-14-8-5-11-17(20)2)24-21-15-9-6-12-18(21)3;/h4*4-15H,1-3H3;/q;;;;+2