Geometry & MOs

Info

ID:

199040

PubChem CID:

79190581

Reduced:

OC6H8 (2)

Stoich.:

AB6C8 (2)

Weight, g/mol:

180.126263

ΔHf, kcal/mol:

-59.63

Dipole, Da:

4.03

IP(EA), eV:

-9.6(0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(3-ethylimidazol-4-yl)-3-methylbut-2-en-1-ol

Drug info:

PubChemData

Smile

CC(=C)C(C1=CC=CC(=C1)COC)O

DOS

IR

Vibrations