Geometry & MOs

Info

ID:	291422
PubChem CID:	112378990
Reduced:	O2N3C18H19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-18.44
Dipole, Da:	4.17
IP(EA), eV:	-9.32(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-4-phenylbutan-2-yl)-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC=C1)O)NC(=O)C2=CC3=C(C=C2)NN=C3

DOS

IR

Vibrations