Geometry & MOs

Info

ID:	172361
PubChem CID:	75498272
Reduced:	ON4C17H18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	55.63
Dipole, Da:	5.3
IP(EA), eV:	-9.25(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(5-propyl-1,3,4-oxadiazol-2-yl)amino]methyl]phenyl]acetamide

Drug info:

PubChemData

Smile

CCCC1=NN=C(O1)NCC2=CC(=CC=C2)C3=CN=CC=C3

DOS

IR

Vibrations