cyclopenta-1,3-diene; naphthalen-1-ol; zirconium(2+)

Systemtic Name: cyclopenta-1,3-diene; naphthalen-1-ol; zirconium(2+) Openeye Name: cyclopenta-1,3-diene; naphthalen-1-ol; zirconium(2+) CAS Name: cyclopenta-1,3-diene; 1-naphthalenol; zirconium(2+) IUPAC Name: cyclopenta-1,3-diene; naphthalen-1-ol; zirconium(2+) Traditional Name: cyclopenta-1,3-diene; 1-naphthol; zirconium(2+) Formula: C30H26O2Zr MolecularWeight: 509.75024

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC=C2C(=C1)C=CC=C2O.C1=CC=C2C(=C1)C=CC=C2O.[Zr+2]

Isomeric SMILES

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC=C2C(=C1)C=CC=C2O.C1=CC=C2C(=C1)C=CC=C2O.[Zr+2]

InChI

InChI=1S/2C10H8O.2C5H5.Zr/c2*11-10-7-3-5-8-4-1-2-6-9(8)10;2*1-2-4-5-3-1;/h2*1-7,11H;2*1-3H,4H2;/q;;2*-1;+2