cyclohexylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride

Systemtic Name: cyclohexylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride Openeye Name: cyclohexylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride CAS Name: cyclohexylidenezirconium; 2-(1-cyclopenta-1,3-dienyl)-4-methyl-1,9-dihydrofluoren-1-ide; dichloride IUPAC Name: cyclohexylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride Traditional Name: cyclohexylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride Formula: C50H50Cl2Zr2-4 MolecularWeight: 904.286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[C-]C2=C1C3=CC=CC=C3C2)C4=CC=CC4.CC1=CC(=[C-]C2=C1C3=CC=CC=C3C2)C4=CC=CC4.C1CCC(=[Zr])CC1.C1CCC(=[Zr])CC1.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC(=[C-]C2=C1C3=CC=CC=C3C2)C4=CC=CC4.CC1=CC(=[C-]C2=C1C3=CC=CC=C3C2)C4=CC=CC4.C1CCC(=[Zr])CC1.C1CCC(=[Zr])CC1.[Cl-].[Cl-]

InChI

InChI=1S/2C19H15.2C6H10.2ClH.2Zr/c2*1-13-10-16(14-6-2-3-7-14)12-17-11-15-8-4-5-9-18(15)19(13)17;2*1-2-4-6-5-3-1;;;;/h2*2-6,8-10H,7,11H2,1H3;2*1-5H2;2*1H;;/q2*-1;;;;;;/p-2