Geometry & MOs

Info

ID:	314243
PubChem CID:	126621005
Reduced:	NOS2C5H9 (1)
Stoich.:	ABC2D5E9 (1)
Weight, g/mol:	131.040485
ΔH_f, kcal/mol:	-44.19
Dipole, Da:	4.92
IP(EA), eV:	-8.67(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-sulfanylethyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(=CC(=O)NSS)C

DOS

IR

Vibrations