cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); chloride

Systemtic Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); chloride Openeye Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; isopropylidenezirconium(2+); chloride CAS Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); chloride IUPAC Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; propan-2-ylidenezirconium(2+); chloride Traditional Name: cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; isopropylidenezirconium(2+); chloride Formula: C21H20ClZr- MolecularWeight: 399.0605

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9.C5H5.C3H6.ClH.Zr/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-2-4-5-3-1;1-3-2;;/h1-5,7-8H,9H2;1-3H,4H2;1-2H3;1H;/q2*-1;;;+2/p-1