Geometry & MOs

Info

ID:	301917
PubChem CID:	123100606
Reduced:	NSO3C18H21 (1)
Stoich.:	ABC3D18E21 (1)
Weight, g/mol:	408.092597
ΔH_f, kcal/mol:	-70.05
Dipole, Da:	3.12
IP(EA), eV:	-9.07(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[2-oxo-2-[[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]amino]ethyl]sulfinylacetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)CS(=O)CCCOC2=CC=CC=C2

DOS

IR

Vibrations