Geometry & MOs

Info

ID:	284621
PubChem CID:	104055999
Reduced:	ClSO2N3C13H20 (1)
Stoich.:	ABC2D3E13F20 (1)
Weight, g/mol:	317.096476
ΔH_f, kcal/mol:	-62.73
Dipole, Da:	5.64
IP(EA), eV:	-8.96(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-3-chloro-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCN(C1)CCNS(=O)(=O)C2=C(C=C(C=C2)CN)Cl

DOS

IR

Vibrations