Geometry & MOs

Info

ID:	155756
PubChem CID:	56367364
Reduced:	BrN2O3H15C16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	377.00112
ΔH_f, kcal/mol:	-76.78
Dipole, Da:	7.31
IP(EA), eV:	-8.84(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=C(C=C1)Br)NC(=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations