Geometry & MOs

Info

ID:	342798
PubChem CID:	127265961
Reduced:	SO3N4C14H18 (1)
Stoich.:	AB3C4D14E18 (1)
Weight, g/mol:	343.108959
ΔH_f, kcal/mol:	-48.84
Dipole, Da:	3.61
IP(EA), eV:	-9.92(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[methyl-(4-methylphenyl)sulfonylamino]propanedioate

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)N2CCN3C(=C(N=N3)CO)C2

DOS

IR

Vibrations