Geometry & MOs

Info

ID:	268810
PubChem CID:	103601055
Reduced:	ClSN2O2C13H21 (1)
Stoich.:	ABC2D2E13F21 (1)
Weight, g/mol:	270.140199
ΔH_f, kcal/mol:	-69.99
Dipole, Da:	5.67
IP(EA), eV:	-8.79(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(benzenesulfonyl)ethyl]-N',N'-dimethylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CN(C)CCCNCCS(=O)(=O)C1=CC=C(C=C1)Cl

DOS

IR

Vibrations