Geometry & MOs

Info

ID:	62185
PubChem CID:	26717905
Reduced:	BrClSN2O3C16H16 (1)
Stoich.:	ABCD2E3F16G16 (1)
Weight, g/mol:	414.0049
ΔH_f, kcal/mol:	-91.84
Dipole, Da:	4.43
IP(EA), eV:	-8.76(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-bromophenyl)sulfonylamino]-N-(2-fluoro-5-methylphenyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)NC(=O)CCNS(=O)(=O)C2=CC=CC=C2Br

DOS

IR

Vibrations