Geometry & MOs

Info

ID:

385164

PubChem CID:

134978426

Reduced:

OC9H9 (2)

Stoich.:

AB9C9 (2)

Weight, g/mol:

274.156895

ΔHf, kcal/mol:

-2.72

Dipole, Da:

0.52

IP(EA), eV:

-9.23(-0.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COCC(=C=C[C@@H](C1=CC=CC=C1)O)C2=CC=CC=C2

DOS

IR

Vibrations