2-cyclopenta-1,3-dien-1-yl-3-methyl-1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium; dichloride

Systemtic Name: 2-cyclopenta-1,3-dien-1-yl-3-methyl-1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium; dichloride Openeye Name: 2-cyclopenta-1,3-dien-1-yl-3-methyl-1,9-dihydrofluoren-1-ide; isopropylidenezirconium; dichloride CAS Name: 2-(1-cyclopenta-1,3-dienyl)-3-methyl-1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium; dichloride IUPAC Name: 2-cyclopenta-1,3-dien-1-yl-3-methyl-1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium; dichloride Traditional Name: 2-cyclopenta-1,3-dien-1-yl-3-methyl-1,9-dihydrofluoren-1-ide; isopropylidenezirconium; dichloride Formula: C44H42Cl2Zr2-4 MolecularWeight: 824.15828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC3=CC=CC=C32)[C-]=C1C4=CC=CC4.CC1=CC2=C(CC3=CC=CC=C32)[C-]=C1C4=CC=CC4.CC(=[Zr])C.CC(=[Zr])C.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC2=C(CC3=CC=CC=C32)[C-]=C1C4=CC=CC4.CC1=CC2=C(CC3=CC=CC=C32)[C-]=C1C4=CC=CC4.CC(=[Zr])C.CC(=[Zr])C.[Cl-].[Cl-]

InChI

InChI=1S/2C19H15.2C3H6.2ClH.2Zr/c2*1-13-10-19-16(11-15-8-4-5-9-17(15)19)12-18(13)14-6-2-3-7-14;2*1-3-2;;;;/h2*2-6,8-10H,7,11H2,1H3;2*1-2H3;2*1H;;/q2*-1;;;;;;/p-2