Geometry & MOs

Info

ID:	190938
PubChem CID:	78080632
Reduced:	SO3N4C18H22 (1)
Stoich.:	AB3C4D18E22 (1)
Weight, g/mol:	329.185175
ΔH_f, kcal/mol:	-69.96
Dipole, Da:	11.16
IP(EA), eV:	-9.18(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N,N-diethyl-1-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=C(N1)C2=CC=CC=C2)C(=O)N3CCN(C4C3CS(=O)(=O)C4)C

DOS

IR

Vibrations