benzene; 1-cyclopenta-1,4-dien-1-ylethyl(dimethyl)phosphane; titanium(3+); trichloride

Systemtic Name: benzene; 1-cyclopenta-1,4-dien-1-ylethyl(dimethyl)phosphane; titanium(3+); trichloride Openeye Name: benzene; 1-cyclopenta-1,4-dien-1-ylethyl(dimethyl)phosphane; titanium(3+); trichloride CAS Name: benzene; 1-(1-cyclopenta-1,4-dienyl)ethyl-dimethylphosphine; titanium(3+); trichloride IUPAC Name: benzene; 1-cyclopenta-1,4-dien-1-ylethyl(dimethyl)phosphane; titanium(3+); trichloride Traditional Name: benzene; 1-cyclopenta-1,4-dien-1-ylethyl(dimethyl)phosphine; titanium(3+); trichloride Formula: C21H24Cl3PTi-3 MolecularWeight: 461.615021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=[C-]CC=C1)P(C)C.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Cl-].[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CC(C1=[C-]CC=C1)P(C)C.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Cl-].[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C9H14P.2C6H5.3ClH.Ti/c1-8(10(2)3)9-6-4-5-7-9;2*1-2-4-6-5-3-1;;;;/h4,6,8H,5H2,1-3H3;2*1-5H;3*1H;/q3*-1;;;;+3/p-3