2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; (diphenylmethylidene)zirconium; dichloride

Systemtic Name: 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; (diphenylmethylidene)zirconium; dichloride Openeye Name: benzhydrylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride CAS Name: 2-(1-cyclopenta-1,3-dienyl)-4-methyl-1,9-dihydrofluoren-1-ide; (diphenylmethylene)zirconium; dichloride IUPAC Name: benzhydrylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride Traditional Name: benzhydrylidenezirconium; 2-cyclopenta-1,3-dien-1-yl-4-methyl-1,9-dihydrofluoren-1-ide; dichloride Formula: C64H50Cl2Zr2-4 MolecularWeight: 1072.4358

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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.C1=CC=C(C=C1)C(=[Zr])C2=CC=CC=C2.C1=CC=C(C=C1)C(=[Zr])C2=CC=CC=C2.[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.C1=CC=C(C=C1)C(=[Zr])C2=CC=CC=C2.C1=CC=C(C=C1)C(=[Zr])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/2C19H15.2C13H10.2ClH.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*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;;;;/h2*2-6,8-10H,7,11H2,1H3;2*1-10H;2*1H;;/q2*-1;;;;;;/p-2