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

Systemtic Name: 2-butylcyclopenta-1,3-diene; chloranylethane; zirconium(3+) Openeye Name: 2-butylcyclopenta-1,3-diene; chloroethane; zirconium(3+) CAS Name: 2-butylcyclopenta-1,3-diene; chloroethane; zirconium(3+) IUPAC Name: 2-butylcyclopenta-1,3-diene; chloroethane; zirconium(3+) Traditional Name: 2-butylcyclopenta-1,3-diene; chloroethane; zirconium(3+) Formula: C20H30ClZr MolecularWeight: 397.1292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[CH2-]CCl.[Zr+3]

Isomeric SMILES

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[CH2-]CCl.[Zr+3]

InChI

InChI=1S/2C9H13.C2H4Cl.Zr/c2*1-2-3-6-9-7-4-5-8-9;1-2-3;/h2*4,7H,2-3,5-6H2,1H3;1-2H2;/q3*-1;+3