Geometry & MOs

Info

ID:	285464
PubChem CID:	104107210
Reduced:	SN2O3C8H16 (1)
Stoich.:	AB2C3D8E16 (1)
Weight, g/mol:	333.02258
ΔH_f, kcal/mol:	-123.34
Dipole, Da:	7.55
IP(EA), eV:	-10.22(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxypentan-2-yl)-3-iodobenzamide

Drug info:

PubChemData

Smile

CC(CC(C)O)NS(=O)(=O)C(C)C#N

DOS

IR

Vibrations