Geometry & MOs

Info

ID:

395820

PubChem CID:

135026645

Reduced:

NO2C25H29 (1)

Stoich.:

AB2C25D29 (1)

Weight, g/mol:

391.178358

ΔHf, kcal/mol:

-38.78

Dipole, Da:

6.65

IP(EA), eV:

-8.38(-0.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-benzyl-2-(4-methoxyphenyl)-5-[(2-oxooxolan-3-yl)methyl]-2,3-dihydropyridin-4-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2CC(=O)C(=CN2CC3=CC=CC=C3)C4CCCCC4

DOS

IR

Vibrations