Geometry & MOs

Info

ID:	124611
PubChem CID:	50889598
Reduced:	NSO4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	323.038292
ΔH_f, kcal/mol:	-157.13
Dipole, Da:	5.92
IP(EA), eV:	-8.96(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[N-(benzenesulfonyl)anilino]propanoyl chloride

Drug info:

PubChemData

Smile

CCS(=O)(=O)N(CCCC(=O)O)C1=CC=CC=C1

DOS

IR

Vibrations