Geometry & MOs

Info

ID:	139366
PubChem CID:	52518646
Reduced:	O3N4H18C21 (1)
Stoich.:	A3B4C18D21 (1)
Weight, g/mol:	382.008686
ΔH_f, kcal/mol:	39.35
Dipole, Da:	3.74
IP(EA), eV:	-8.9(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(5-chlorothiophen-2-yl)sulfonyl-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]azanide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](C(=O)NC2=CC=CC=C2)NCC3=NC(=NO3)C4=CC=CO4

DOS

IR

Vibrations