Geometry & MOs

Info

ID:	273291
PubChem CID:	103770836
Reduced:	NO4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	301.090328
ΔH_f, kcal/mol:	-141.48
Dipole, Da:	4.58
IP(EA), eV:	-9.89(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(2-hydroxy-4-methylpentyl)-5-methylsulfanylbenzamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC(=O)C2=CC=CC=C2O1)O

DOS

IR

Vibrations