cyclohexylidenezirconium; 1-cyclopenta-1,3-dien-1-ylinden-1-ide; dichloride

Systemtic Name: cyclohexylidenezirconium; 1-cyclopenta-1,3-dien-1-ylinden-1-ide; dichloride Openeye Name: cyclohexylidenezirconium; 1-cyclopenta-1,3-dien-1-ylinden-1-ide; dichloride CAS Name: cyclohexylidenezirconium; 1-(1-cyclopenta-1,3-dienyl)inden-1-ide; dichloride IUPAC Name: cyclohexylidenezirconium; 1-cyclopenta-1,3-dien-1-ylinden-1-ide; dichloride Traditional Name: cyclohexylidenezirconium; 1-cyclopenta-1,3-dien-1-ylinden-1-ide; dichloride Formula: C40H42Cl2Zr2-4 MolecularWeight: 776.11548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[Zr])CC1.C1CCC(=[Zr])CC1.C1C=CC=C1[C-]2C=CC3=CC=CC=C23.C1C=CC=C1[C-]2C=CC3=CC=CC=C23.[Cl-].[Cl-]

Isomeric SMILES

C1CCC(=[Zr])CC1.C1CCC(=[Zr])CC1.C1C=CC=C1[C-]2C=CC3=CC=CC=C23.C1C=CC=C1[C-]2C=CC3=CC=CC=C23.[Cl-].[Cl-]

InChI

InChI=1S/2C14H11.2C6H10.2ClH.2Zr/c2*1-2-6-11(5-1)14-10-9-12-7-3-4-8-13(12)14;2*1-2-4-6-5-3-1;;;;/h2*1-5,7-10H,6H2;2*1-5H2;2*1H;;/q2*-1;;;;;;/p-2