Geometry & MOs

Info

ID:

335798

PubChem CID:

127254660

Reduced:

N3O3H23C25 (1)

Stoich.:

A3B3C23D25 (1)

Weight, g/mol:

264.085855

ΔHf, kcal/mol:

-36.1

Dipole, Da:

1.28

IP(EA), eV:

-9.29(-1.08)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-methoxy-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-1H-pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1C2CC(C1C=C2)CNC(=O)CN3C4C5=CC=CC=C5C(=O)N4C6=CC=CC=C6C3=O

DOS

IR

Vibrations