Geometry & MOs

Info

ID:	270990
PubChem CID:	103639104
Reduced:	BrN2O3H13C15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	317.04153
ΔH_f, kcal/mol:	-10.21
Dipole, Da:	3.0
IP(EA), eV:	-9.3(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-2,3-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2=C(C(=CC=C2)Br)C)[N+](=O)[O-]

DOS

IR

Vibrations