Geometry & MOs

Info

ID:

23543

PubChem CID:

604486

Reduced:

NOC12H13 (1)

Stoich.:

ABC12D13 (1)

Weight, g/mol:

187.099714

ΔHf, kcal/mol:

-24.68

Dipole, Da:

4.44

IP(EA), eV:

-8.74(-0.09)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-methyl-6-phenyl-3,4-dihydro-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=C(NC(=O)CC1)C2=CC=CC=C2

DOS

IR

Vibrations