Geometry & MOs

Info

ID:	120695
PubChem CID:	50740421
Reduced:	BrClSN2O3H18C21 (1)
Stoich.:	ABCD2E3F18G21 (1)
Weight, g/mol:	472.04563
ΔH_f, kcal/mol:	-57.13
Dipole, Da:	3.62
IP(EA), eV:	-8.84(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)Br

DOS

IR

Vibrations