Geometry & MOs

Info

ID:	56357
PubChem CID:	17425169
Reduced:	SN3O5H21C22 (1)
Stoich.:	AB3C5D21E22 (1)
Weight, g/mol:	389.06009
ΔH_f, kcal/mol:	-118.06
Dipole, Da:	5.46
IP(EA), eV:	-8.62(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)-5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4)OC1

DOS

IR

Vibrations