Geometry & MOs

Info

ID:	196678
PubChem CID:	78863465
Reduced:	ClNSO3H12C18 (1)
Stoich.:	ABCD3E12F18 (1)
Weight, g/mol:	309.151098
ΔH_f, kcal/mol:	-33.63
Dipole, Da:	5.85
IP(EA), eV:	-8.82(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-cyanophenyl)-N-[3-(diethylamino)propyl]methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC=C2Cl)OS(=O)(=O)CC3=CC(=CC=C3)C#N

DOS

IR

Vibrations