Geometry & MOs

Info

ID:	274325
PubChem CID:	103808559
Reduced:	BrON2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	304.02113
ΔH_f, kcal/mol:	-38.15
Dipole, Da:	4.96
IP(EA), eV:	-9.22(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NC(=O)CC(C)CN

DOS

IR

Vibrations