Geometry & MOs

Info

ID:	273306
PubChem CID:	103770863
Reduced:	ClNO4C15H22 (1)
Stoich.:	ABC4D15E22 (1)
Weight, g/mol:	333.080157
ΔH_f, kcal/mol:	-171.66
Dipole, Da:	2.29
IP(EA), eV:	-8.87(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-hydroxy-4-methylpentyl)-3-methylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC(=C(C(=C1)Cl)OC)OC)O

DOS

IR

Vibrations