Geometry & MOs

Info

ID:	26443
PubChem CID:	647885
Reduced:	SN4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	357.045313
ΔH_f, kcal/mol:	87.38
Dipole, Da:	4.75
IP(EA), eV:	-8.89(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[5-[4-(ethylsulfonylamino)phenyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetate

Drug info:

PubChemData

Smile

CC1=NN=C(N1N)SCC2=CC=CC=C2

DOS

IR

Vibrations