Geometry & MOs

Info

ID:	280725
PubChem CID:	103850975
Reduced:	NO4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	297.139865
ΔH_f, kcal/mol:	-152.43
Dipole, Da:	2.16
IP(EA), eV:	-9.64(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-3-(4-methylphenyl)sulfanylpropanamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C1=CC2=C(COC2)C=C1

DOS

IR

Vibrations