2-butyl-3-methyl-cyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 2-butyl-3-methyl-cyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 2-butyl-3-methyl-cyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 2-butyl-3-methylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 2-butyl-3-methylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 2-butyl-3-methyl-cyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C40H60Cl2Zr2-2 MolecularWeight: 794.2584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1C.CCCCC1=[C-]CC=C1C.CCCCC1=[C-]CC=C1C.CCCCC1=[C-]CC=C1C.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCC1=[C-]CC=C1C.CCCCC1=[C-]CC=C1C.CCCCC1=[C-]CC=C1C.CCCCC1=[C-]CC=C1C.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C10H15.2ClH.2Zr/c4*1-3-4-7-10-8-5-6-9(10)2;;;;/h4*6H,3-5,7H2,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2