Geometry & MOs

Info

ID:	124609
PubChem CID:	50889596
Reduced:	BrClNSO3H15C16 (1)
Stoich.:	ABCDE3F15G16 (1)
Weight, g/mol:	275.038292
ΔH_f, kcal/mol:	-80.28
Dipole, Da:	6.37
IP(EA), eV:	-9.49(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-ethylsulfonylanilino)propanoyl chloride

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N(C(C)C(=O)Cl)S(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations