Geometry & MOs

Info

ID:	273631
PubChem CID:	103771522
Reduced:	SN2O2C16H22 (1)
Stoich.:	AB2C2D16E22 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-79.3
Dipole, Da:	2.29
IP(EA), eV:	-9.18(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylphenoxy)-N-(2-hydroxy-4-methylpentyl)acetamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)CCC1=NC2=CC=CC=C2S1)O

DOS

IR

Vibrations