Geometry & MOs

Info

ID:	70096
PubChem CID:	47207576
Reduced:	ClNSO3C13H18 (1)
Stoich.:	ABCD3E13F18 (1)
Weight, g/mol:	366.97391
ΔH_f, kcal/mol:	-141.9
Dipole, Da:	1.99
IP(EA), eV:	-8.9(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-iodophenyl)-2-propylsulfonylacetamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)C(C)C(=O)NC1=CC(=C(C=C1)C)Cl

DOS

IR

Vibrations