2-methanidylpropan-2-ylbenzene; nickel(2+); triphenylphosphane

Systemtic Name: 2-methanidylpropan-2-ylbenzene; nickel(2+); triphenylphosphane Openeye Name: nickelous; (1-methanidyl-1-methyl-ethyl)benzene; triphenylphosphane CAS Name: 2-methanidylpropan-2-ylbenzene; nickel(2+); triphenylphosphine IUPAC Name: 2-methanidylpropan-2-ylbenzene; nickel(2+); triphenylphosphane Traditional Name: nickelous; (1-methanidyl-1-methyl-ethyl)benzene; triphenylphosphine Formula: C46H42NiP2 MolecularWeight: 715.466602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)([CH2-])C1=C[C-]=CC=C1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2]

Isomeric SMILES

CC(C)([CH2-])C1=C[C-]=CC=C1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2]

InChI

InChI=1S/2C18H15P.C10H12.Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-10(2,3)9-7-5-4-6-8-9;/h2*1-15H;4-5,7-8H,1H2,2-3H3;/q;;-2;+2