Geometry & MOs

Info

ID:	251128
PubChem CID:	103101681
Reduced:	SN3O3C12H19 (1)
Stoich.:	AB3C3D12E19 (1)
Weight, g/mol:	305.06009
ΔH_f, kcal/mol:	-117.57
Dipole, Da:	4.83
IP(EA), eV:	-9.59(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations