benzene; 2-methylcyclopenta-1,3-diene; zirconium(4+)

Systemtic Name: benzene; 2-methylcyclopenta-1,3-diene; zirconium(4+) Openeye Name: benzene; 2-methylcyclopenta-1,3-diene; zirconium(4+) CAS Name: benzene; 2-methylcyclopenta-1,3-diene; zirconium(4+) IUPAC Name: benzene; 2-methylcyclopenta-1,3-diene; zirconium(4+) Traditional Name: benzene; 2-methylcyclopenta-1,3-diene; zirconium(4+) Formula: C24H22Zr MolecularWeight: 401.65548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

Isomeric SMILES

CC1=[C-]CC=C1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

InChI

InChI=1S/C6H7.3C6H5.Zr/c1-6-4-2-3-5-6;3*1-2-4-6-5-3-1;/h2,4H,3H2,1H3;3*1-5H;/q4*-1;+4