Geometry & MOs

Info

ID:	271423
PubChem CID:	103676368
Reduced:	NO2S2C14H19 (1)
Stoich.:	AB2C2D14E19 (1)
Weight, g/mol:	313.144471
ΔH_f, kcal/mol:	-71.27
Dipole, Da:	3.12
IP(EA), eV:	-8.9(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-methylphenoxy)-N-(2-hydroxy-4,4-dimethylpentyl)acetamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(CNC(=O)C1=CC2=C(S1)C=CS2)O

DOS

IR

Vibrations