but-3-en-1-olate; 2-methylcyclopenta-1,3-diene; zirconium(4+)

Systemtic Name: but-3-en-1-olate; 2-methylcyclopenta-1,3-diene; zirconium(4+) Openeye Name: but-3-en-1-olate; 2-methylcyclopenta-1,3-diene; zirconium(4+) CAS Name: 3-buten-1-olate; 2-methylcyclopenta-1,3-diene; zirconium(4+) IUPAC Name: but-3-en-1-olate; 2-methylcyclopenta-1,3-diene; zirconium(4+) Traditional Name: but-3-en-1-olate; 2-methylcyclopenta-1,3-diene; zirconium(4+) Formula: C18H28O3Zr MolecularWeight: 383.63712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.C=CCC[O-].C=CCC[O-].C=CCC[O-].[Zr+4]

Isomeric SMILES

CC1=[C-]CC=C1.C=CCC[O-].C=CCC[O-].C=CCC[O-].[Zr+4]

InChI

InChI=1S/C6H7.3C4H7O.Zr/c1-6-4-2-3-5-6;3*1-2-3-4-5;/h2,4H,3H2,1H3;3*2H,1,3-4H2;/q4*-1;+4