cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 3-methylbutylidenezirconium(2+); dichloride

Systemtic Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 3-methylbutylidenezirconium(2+); dichloride Openeye Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 3-methylbutylidenezirconium(2+); dichloride CAS Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 3-methylbutylidenezirconium(2+); dichloride IUPAC Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 3-methylbutylidenezirconium(2+); dichloride Traditional Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 3-methylbutylidenezirconium(2+); dichloride Formula: C23H24Cl2Zr-2 MolecularWeight: 462.56666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=[Zr+2].C1C=CC=[C-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

CC(C)CC=[Zr+2].C1C=CC=[C-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C13H9.C5H5.C5H10.2ClH.Zr/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-2-4-5-3-1;1-4-5(2)3;;;/h1-5,7-8H,9H2;1-3H,4H2;1,5H,4H2,2-3H3;2*1H;/q2*-1;;;;+2/p-2