Geometry & MOs

Info

ID:	156424
PubChem CID:	56370535
Reduced:	BrNS2O3C17H18 (1)
Stoich.:	ABC2D3E17F18 (1)
Weight, g/mol:	423.05038
ΔH_f, kcal/mol:	-81.6
Dipole, Da:	5.72
IP(EA), eV:	-9.16(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)sulfonyl-2-methyl-N-(2-phenylpropyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations