3,5-dibutyl-1,2-dimethyl-cyclopenta-1,3-diene; zirconium; dichloride

Systemtic Name: 3,5-dibutyl-1,2-dimethyl-cyclopenta-1,3-diene; zirconium; dichloride Openeye Name: 3,5-dibutyl-1,2-dimethyl-cyclopenta-1,3-diene; zirconium; dichloride CAS Name: 3,5-dibutyl-1,2-dimethylcyclopenta-1,3-diene; zirconium; dichloride IUPAC Name: 3,5-dibutyl-1,2-dimethylcyclopenta-1,3-diene; zirconium; dichloride Traditional Name: 3,5-dibutyl-1,2-dimethyl-cyclopenta-1,3-diene; zirconium; dichloride Formula: C60H104Cl2Zr2-2 MolecularWeight: 1078.82176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=C(C(=C1C)C)CCCC.CCCCC1C=C(C(=C1C)C)CCCC.CCCCC1C=C(C(=C1C)C)CCCC.CCCCC1C=C(C(=C1C)C)CCCC.[Cl-].[Cl-].[Zr].[Zr]

Isomeric SMILES

CCCCC1C=C(C(=C1C)C)CCCC.CCCCC1C=C(C(=C1C)C)CCCC.CCCCC1C=C(C(=C1C)C)CCCC.CCCCC1C=C(C(=C1C)C)CCCC.[Cl-].[Cl-].[Zr].[Zr]

InChI

InChI=1S/4C15H26.2ClH.2Zr/c4*1-5-7-9-14-11-15(10-8-6-2)13(4)12(14)3;;;;/h4*11,14H,5-10H2,1-4H3;2*1H;;/p-2