Geometry & MOs

Info

ID:	274552
PubChem CID:	103810122
Reduced:	O2N5C12H21 (1)
Stoich.:	A2B5C12D21 (1)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-39.55
Dipole, Da:	1.71
IP(EA), eV:	-8.95(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)CN2CCC(CC2)N

DOS

IR

Vibrations