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

Systemtic Name: benzene; cyclopenta-1,3-diene; zirconium(4+) Openeye Name: benzene; cyclopenta-1,3-diene; zirconium(4+) CAS Name: benzene; cyclopenta-1,3-diene; zirconium(4+) IUPAC Name: benzene; cyclopenta-1,3-diene; zirconium(4+) Traditional Name: benzene; cyclopenta-1,3-diene; zirconium(4+) Formula: C23H20Zr MolecularWeight: 387.6289

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

Isomeric SMILES

C1C=CC=[C-]1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

InChI

InChI=1S/3C6H5.C5H5.Zr/c3*1-2-4-6-5-3-1;1-2-4-5-3-1;/h3*1-5H;1-3H,4H2;/q4*-1;+4