Geometry & MOs

Info

ID:	120693
PubChem CID:	50740303
Reduced:	ClSN2O3C16H17 (1)
Stoich.:	ABC2D3E16F17 (1)
Weight, g/mol:	517.0307
ΔH_f, kcal/mol:	-95.48
Dipole, Da:	2.52
IP(EA), eV:	-8.64(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromophenyl)sulfonylamino]-N-(2-methyl-4-nitrophenyl)-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C(C)NS(=O)(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations