Geometry & MOs

Info

ID:	57667
PubChem CID:	22431824
Reduced:	N3O3C20H21 (1)
Stoich.:	A3B3C20D21 (1)
Weight, g/mol:	378.136176
ΔH_f, kcal/mol:	-34.08
Dipole, Da:	2.65
IP(EA), eV:	-9.06(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(benzenesulfonylmethyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-1,3,4-oxadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CCNC(=O)C2=NN=C(O2)CC3=CC=CC=C3OC

DOS

IR

Vibrations