Geometry & MOs

Info

ID:	211750
PubChem CID:	81053185
Reduced:	ClN2O2C13H19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	318.107185
ΔH_f, kcal/mol:	-84.53
Dipole, Da:	4.42
IP(EA), eV:	-8.74(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-aminophenyl)sulfanyl-N-(2-ethoxyethyl)-N-methylethanesulfonamide

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=C(C=CC(=C1)N)Cl

DOS

IR

Vibrations