2-methylcyclopenta-1,3-diene; titanium(3+); trifluoromethylbenzene; chloride

Systemtic Name: 2-methylcyclopenta-1,3-diene; titanium(3+); trifluoromethylbenzene; chloride Openeye Name: 2-methylcyclopenta-1,3-diene; titanium(3+); trifluoromethylbenzene; chloride CAS Name: 2-methylcyclopenta-1,3-diene; titanium(3+); trifluoromethylbenzene; chloride IUPAC Name: 2-methylcyclopenta-1,3-diene; titanium(3+); trifluoromethylbenzene; chloride Traditional Name: 2-methylcyclopenta-1,3-diene; titanium(3+); trifluoromethylbenzene; chloride Formula: C19H18ClF3Ti- MolecularWeight: 386.66143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.CC1=[C-]CC=C1.C1=CC=C([C-]=C1)C(F)(F)F.[Cl-].[Ti+3]

Isomeric SMILES

CC1=[C-]CC=C1.CC1=[C-]CC=C1.C1=CC=C([C-]=C1)C(F)(F)F.[Cl-].[Ti+3]

InChI

InChI=1S/C7H4F3.2C6H7.ClH.Ti/c8-7(9,10)6-4-2-1-3-5-6;2*1-6-4-2-3-5-6;;/h1-4H;2*2,4H,3H2,1H3;1H;/q3*-1;;+3/p-1