Geometry & MOs

Info

ID:	24496
PubChem CID:	610606
Reduced:	BrNO2H16C21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	393.03644
ΔH_f, kcal/mol:	-4.4
Dipole, Da:	5.46
IP(EA), eV:	-8.71(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzoyl-N-(3-bromo-4-methylphenyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)Br

DOS

IR

Vibrations