3-oxidanylthiobenzaldehyde; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(2+)

Systemtic Name: 3-oxidanylthiobenzaldehyde; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(2+) Openeye Name: 3-hydroxythiobenzaldehyde; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(2+) CAS Name: 3-hydroxythiobenzaldehyde; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(2+) IUPAC Name: 3-hydroxythiobenzaldehyde; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(2+) Traditional Name: 3-hydroxythiobenzaldehyde; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(2+) Formula: C32H38O2S2Zr MolecularWeight: 609.99692

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C=C(C(=C1C)C)C.C[C-]1C=C(C(=C1C)C)C.C1=CC(=CC(=C1)O)C=S.C1=CC(=CC(=C1)O)C=S.[Zr+2]

Isomeric SMILES

C[C-]1C=C(C(=C1C)C)C.C[C-]1C=C(C(=C1C)C)C.C1=CC(=CC(=C1)O)C=S.C1=CC(=CC(=C1)O)C=S.[Zr+2]

InChI

InChI=1S/2C9H13.2C7H6OS.Zr/c2*1-6-5-7(2)9(4)8(6)3;2*8-7-3-1-2-6(4-7)5-9;/h2*5H,1-4H3;2*1-5,8H;/q2*-1;;;+2