1-chloranyl-4-cyclopenta-1,4-dien-1-yl-benzene; zirconium(2+); dichloride

Systemtic Name: 1-chloranyl-4-cyclopenta-1,4-dien-1-yl-benzene; zirconium(2+); dichloride Openeye Name: 1-chloro-4-cyclopenta-1,4-dien-1-yl-benzene; zirconium(2+); dichloride CAS Name: 1-chloro-4-(1-cyclopenta-1,4-dienyl)benzene; zirconium(2+); dichloride IUPAC Name: 1-chloro-4-cyclopenta-1,4-dien-1-ylbenzene; zirconium(2+); dichloride Traditional Name: 1-chloro-4-cyclopenta-1,4-dien-1-yl-benzene; zirconium(2+); dichloride Formula: C22H16Cl4Zr-2 MolecularWeight: 513.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=[C-]1)C2=CC=C(C=C2)Cl.C1C=CC(=[C-]1)C2=CC=C(C=C2)Cl.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

C1C=CC(=[C-]1)C2=CC=C(C=C2)Cl.C1C=CC(=[C-]1)C2=CC=C(C=C2)Cl.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/2C11H8Cl.2ClH.Zr/c2*12-11-7-5-10(6-8-11)9-3-1-2-4-9;;;/h2*1,3,5-8H,2H2;2*1H;/q2*-1;;;+2/p-2