Geometry & MOs

Info

ID:

224532

PubChem CID:

85344563

Reduced:

OC6H7 (2)

Stoich.:

AB6C7 (2)

Weight, g/mol:

190.146999

ΔHf, kcal/mol:

-60.87

Dipole, Da:

4.1

IP(EA), eV:

-10.15(-0.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-methyl-2-octa-1,5-dienylimidazole

Drug info:

PubChemData

Smile

CC12CC3=CC(=O)CC3C1CCC2=O

DOS

IR

Vibrations