ethanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+)

Systemtic Name: ethanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) Openeye Name: ethanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) CAS Name: ethanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) IUPAC Name: ethanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) Traditional Name: ethanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; zirconium(4+) Formula: C24H40O2Zr MolecularWeight: 451.7972

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Zr+4]

Isomeric SMILES

CC[O-].CC[O-].CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Zr+4]

InChI

InChI=1S/2C10H15.2C2H5O.Zr/c2*1-7-6-10(4,5)9(3)8(7)2;2*1-2-3;/h2*1-5H3;2*2H2,1H3;/q4*-1;+4