Geometry & MOs

Info

ID:	29789
PubChem CID:	837287
Reduced:	OSN2C16H20 (1)
Stoich.:	ABC2D16E20 (1)
Weight, g/mol:	285.136493
ΔH_f, kcal/mol:	-33.1
Dipole, Da:	3.87
IP(EA), eV:	-8.58(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3-hydroxy-4-methylphenyl)-2-(4-methylphenoxy)propanamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCC3CCCC3

DOS

IR

Vibrations