cyclopenta-1,3-diene; (2-methylphenyl)methylidenezirconium(2+); dichloride

Systemtic Name: cyclopenta-1,3-diene; (2-methylphenyl)methylidenezirconium(2+); dichloride Openeye Name: cyclopenta-1,3-diene; o-tolylmethylenezirconium(2+); dichloride CAS Name: cyclopenta-1,3-diene; (2-methylphenyl)methylidenezirconium(2+); dichloride IUPAC Name: cyclopenta-1,3-diene; (2-methylphenyl)methylidenezirconium(2+); dichloride Traditional Name: cyclopenta-1,3-diene; (2-methylbenzylidene)zirconium(2+); dichloride Formula: C18H18Cl2Zr-2 MolecularWeight: 396.46552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=[Zr+2].C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC=CC=C1C=[Zr+2].C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-]

InChI

InChI=1S/C8H8.2C5H5.2ClH.Zr/c1-7-5-3-4-6-8(7)2;2*1-2-4-5-3-1;;;/h1,3-6H,2H3;2*1-3H,4H2;2*1H;/q;2*-1;;;+2/p-2