Geometry & MOs

Info

ID:	284615
PubChem CID:	104055735
Reduced:	ClSN2O3C14H21 (1)
Stoich.:	ABC2D3E14F21 (1)
Weight, g/mol:	333.09139
ΔH_f, kcal/mol:	-117.04
Dipole, Da:	8.53
IP(EA), eV:	-9.44(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(aminomethyl)-3-chlorophenyl]sulfonylamino]-N-propylpropanamide

Drug info:

PubChemData

Smile

CCN(CC1CCCO1)S(=O)(=O)C2=CC(=C(C=C2)CN)Cl

DOS

IR

Vibrations