prop-1-ene; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); chloride

Systemtic Name: prop-1-ene; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); chloride Openeye Name: prop-1-ene; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); chloride CAS Name: 1-propene; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); chloride IUPAC Name: prop-1-ene; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); chloride Traditional Name: prop-1-ene; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); chloride Formula: C21H31ClZr MolecularWeight: 410.14784

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Descriptors Computed from Structure

Canonical SMILES:

CC1[C-]=C(C(=C1C)C)C.CC1[C-]=C(C(=C1C)C)C.[CH2-]C=C.[Cl-].[Zr+4]

Isomeric SMILES

CC1[C-]=C(C(=C1C)C)C.CC1[C-]=C(C(=C1C)C)C.[CH2-]C=C.[Cl-].[Zr+4]

InChI

InChI=1S/2C9H13.C3H5.ClH.Zr/c2*1-6-5-7(2)9(4)8(6)3;1-3-2;;/h2*6H,1-4H3;3H,1-2H2;1H;/q3*-1;;+4/p-1