[cyclopenta-1,4-dien-1-yl(phenyl)methyl]benzene; hydride; zirconium(4+)

Systemtic Name: [cyclopenta-1,4-dien-1-yl(phenyl)methyl]benzene; hydride; zirconium(4+) Openeye Name: [cyclopenta-1,4-dien-1-yl(phenyl)methyl]benzene; hydride; zirconium(4+) CAS Name: [1-cyclopenta-1,4-dienyl(phenyl)methyl]benzene; hydride; zirconium(4+) IUPAC Name: [cyclopenta-1,4-dien-1-yl(phenyl)methyl]benzene; hydride; zirconium(4+) Traditional Name: [cyclopenta-1,4-dien-1-yl(phenyl)methyl]benzene; hydride; zirconium(4+) Formula: C36H32Zr MolecularWeight: 555.86328

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Descriptors Computed from Structure

Canonical SMILES:

[H-].[H-].C1C=CC(=[C-]1)C(C2=CC=CC=C2)C3=CC=CC=C3.C1C=CC(=[C-]1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Zr+4]

Isomeric SMILES

[H-].[H-].C1C=CC(=[C-]1)C(C2=CC=CC=C2)C3=CC=CC=C3.C1C=CC(=[C-]1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Zr+4]

InChI

InChI=1S/2C18H15.Zr.2H/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;;;/h2*1-7,9-13,18H,8H2;;;/q2*-1;+4;2*-1