Geometry & MOs

Info

ID:	53659
PubChem CID:	14717696
Reduced:	SO2C8H18 (1)
Stoich.:	AB2C8D18 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-116.49
Dipole, Da:	1.66
IP(EA), eV:	-8.7(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-hydroxy-2-methyl-4-phenylbut-2-enamide

Drug info:

PubChemData

Smile

C(CCSCCCCO)CO

DOS

IR

Vibrations