Geometry & MOs

Info

ID:	273292
PubChem CID:	103770837
Reduced:	ClNSO2C14H20 (1)
Stoich.:	ABCD2E14F20 (1)
Weight, g/mol:	299.128821
ΔH_f, kcal/mol:	-101.29
Dipole, Da:	2.18
IP(EA), eV:	-8.78(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-methylphenoxy)-N-(2-hydroxy-4-methylpentyl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations