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

Systemtic Name: 2-cyclopenta-1,4-dien-1-yl-2-methyl-adamantane; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Openeye Name: 2-cyclopenta-1,4-dien-1-yl-2-methyl-adamantane; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride CAS Name: 2-(1-cyclopenta-1,4-dienyl)-2-methyladamantane; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride IUPAC Name: 2-cyclopenta-1,4-dien-1-yl-2-methyladamantane; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Traditional Name: 2-cyclopenta-1,4-dien-1-yl-2-methyl-adamantane; 1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Formula: C29H30Cl2Zr-2 MolecularWeight: 540.6785

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC3CC(C2)CC1C3)C4=CC[C-]=C4.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1(C2CC3CC(C2)CC1C3)C4=CC[C-]=C4.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C16H21.C13H9.2ClH.Zr/c1-16(13-4-2-3-5-13)14-7-11-6-12(9-14)10-15(16)8-11;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;;;/h4-5,11-12,14-15H,2,6-10H2,1H3;1-5,7-8H,9H2;2*1H;/q2*-1;;;+2/p-2