Geometry & MOs

Info

ID:	251133
PubChem CID:	103101692
Reduced:	SO3N4C10H16 (1)
Stoich.:	AB3C4D10E16 (1)
Weight, g/mol:	305.06009
ΔH_f, kcal/mol:	-97.06
Dipole, Da:	6.46
IP(EA), eV:	-9.68(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(aminomethyl)-3-chlorophenyl]sulfonyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)S(=O)(=O)C1=CN=C(C=C1)CN

DOS

IR

Vibrations