Geometry & MOs

Info

ID:	155712
PubChem CID:	56367102
Reduced:	BrN4O4C17H19 (1)
Stoich.:	AB4C4D17E19 (1)
Weight, g/mol:	392.01941
ΔH_f, kcal/mol:	-131.48
Dipole, Da:	7.11
IP(EA), eV:	-8.9(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-bromophenyl)-2-(4-methylphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=C(C=C1)Br)NC(=O)CN2C(=O)C(NC2=O)(C)C3CC3

DOS

IR

Vibrations