Geometry & MOs

Info

ID:	155773
PubChem CID:	56367488
Reduced:	BrN2S2O3C20H21 (1)
Stoich.:	AB2C2D3E20F21 (1)
Weight, g/mol:	365.97707
ΔH_f, kcal/mol:	-77.92
Dipole, Da:	5.35
IP(EA), eV:	-8.77(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-bromophenyl)-2-chlorobenzamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=C(C=C1)Br)NC(=O)COC2=CC=C(C=C2)C3SCCCS3

DOS

IR

Vibrations