Geometry & MOs

Info

ID:	275585
PubChem CID:	103816684
Reduced:	FNSO3C15H20 (1)
Stoich.:	ABCD3E15F20 (1)
Weight, g/mol:	283.124215
ΔH_f, kcal/mol:	-152.42
Dipole, Da:	1.47
IP(EA), eV:	-8.78(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-4-(methylsulfanylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(C(CO)SC)NC(=O)/C=C/C1=CC(=C(C=C1)OC)F

DOS

IR

Vibrations