Geometry & MOs

Info

ID:	124733
PubChem CID:	50894315
Reduced:	ClNSO4H16C17 (1)
Stoich.:	ABCD4E16F17 (1)
Weight, g/mol:	289.053942
ΔH_f, kcal/mol:	-95.76
Dipole, Da:	4.27
IP(EA), eV:	-8.94(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[benzyl(ethylsulfonyl)amino]propanoyl chloride

Drug info:

PubChemData

Smile

C=CCOC1=CC=CC(=C1)N(CC(=O)Cl)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations