Geometry & MOs

Info

ID:	120879
PubChem CID:	50748299
Reduced:	SO3N5C18H21 (1)
Stoich.:	AB3C5D18E21 (1)
Weight, g/mol:	394.200491
ΔH_f, kcal/mol:	-36.11
Dipole, Da:	6.22
IP(EA), eV:	-8.95(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(6-methyl-2-oxo-1-propan-2-ylpyridin-3-yl)-1,2,4-oxadiazol-5-yl]-N-(2-phenylethyl)propanamide

Drug info:

PubChemData

Smile

CCCN1C(=CC=C(C1=O)C2=NOC(=N2)CCC(=O)NC3=NC(=CS3)C)C

DOS

IR

Vibrations