Geometry & MOs

Info

ID:

70632

PubChem CID:

48413621

Reduced:

O3N6H20C21 (1)

Stoich.:

A3B6C20D21 (1)

Weight, g/mol:

365.173942

ΔHf, kcal/mol:

27.88

Dipole, Da:

5.91

IP(EA), eV:

-9.68(-1.43)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-(methoxymethyl)-N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NC(=O)CN3C(=O)C4=CC=CC=C4N=N3

DOS

IR

Vibrations