Geometry & MOs

Info

ID:	1316
PubChem CID:	4150
Reduced:	NSO3C19H21 (1)
Stoich.:	ABC3D19E21 (1)
Weight, g/mol:	343.124215
ΔH_f, kcal/mol:	-55.4
Dipole, Da:	5.58
IP(EA), eV:	-9.02(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-5-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpentanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CSCCCCC(=O)NO

DOS

IR

Vibrations