Geometry & MOs

Info

ID:	278052
PubChem CID:	103833016
Reduced:	O2N4C13H16 (1)
Stoich.:	A2B4C13D16 (1)
Weight, g/mol:	240.158626
ΔH_f, kcal/mol:	-16.76
Dipole, Da:	3.46
IP(EA), eV:	-8.52(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pentanamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)CC2=CC=CC=C2N

DOS

IR

Vibrations