cyclohexylidenezirconium; 5-cyclopenta-1,3-dien-1-yl-1,2,3-triethyl-cyclopenta-1,3-diene; dichloride

Systemtic Name: cyclohexylidenezirconium; 5-cyclopenta-1,3-dien-1-yl-1,2,3-triethyl-cyclopenta-1,3-diene; dichloride Openeye Name: cyclohexylidenezirconium; 5-cyclopenta-1,3-dien-1-yl-1,2,3-triethyl-cyclopenta-1,3-diene; dichloride CAS Name: cyclohexylidenezirconium; 5-(1-cyclopenta-1,3-dienyl)-1,2,3-triethylcyclopenta-1,3-diene; dichloride IUPAC Name: cyclohexylidenezirconium; 5-cyclopenta-1,3-dien-1-yl-1,2,3-triethylcyclopenta-1,3-diene; dichloride Traditional Name: cyclohexylidenezirconium; 5-cyclopenta-1,3-dien-1-yl-1,2,3-triethyl-cyclopenta-1,3-diene; dichloride Formula: C22H31Cl2Zr-3 MolecularWeight: 457.61154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[C-]C(C(=C1CC)CC)C2=CC=CC2.C1CCC(=[Zr])CC1.[Cl-].[Cl-]

Isomeric SMILES

CCC1=[C-]C(C(=C1CC)CC)C2=CC=CC2.C1CCC(=[Zr])CC1.[Cl-].[Cl-]

InChI

InChI=1S/C16H21.C6H10.2ClH.Zr/c1-4-12-11-16(13-9-7-8-10-13)15(6-3)14(12)5-2;1-2-4-6-5-3-1;;;/h7-9,16H,4-6,10H2,1-3H3;1-5H2;2*1H;/q-1;;;;/p-2