Geometry & MOs

Info

ID:	420631
PubChem CID:	135114494
Reduced:	O3N4C19H20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	352.117155
ΔH_f, kcal/mol:	-21.13
Dipole, Da:	4.7
IP(EA), eV:	-10.14(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-naphthalen-1-yl-4-oxobutanoyl)amino]methyl]-1,2,4-oxadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=NOC2=N1)C)C(=O)N[C@H]3COC[C@H]3CC4=CC=NC=C4

DOS

IR

Vibrations