2-butylcyclopenta-1,3-diene; zirconium(2+); hydrochloride

Systemtic Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); hydrochloride Openeye Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); hydrochloride CAS Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); hydrochloride IUPAC Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); hydrochloride Traditional Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); hydrochloride Formula: C18H27ClZr MolecularWeight: 370.08398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.Cl.[Zr+2]

Isomeric SMILES

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.Cl.[Zr+2]

InChI

InChI=1S/2C9H13.ClH.Zr/c2*1-2-3-6-9-7-4-5-8-9;;/h2*4,7H,2-3,5-6H2,1H3;1H;/q2*-1;;+2