Geometry & MOs

Info

ID:	58308
PubChem CID:	24697662
Reduced:	OSN4C13H14 (1)
Stoich.:	ABC4D13E14 (1)
Weight, g/mol:	322.0117
ΔH_f, kcal/mol:	23.45
Dipole, Da:	3.47
IP(EA), eV:	-8.76(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-2-methylphenyl)-5-bromo-2-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=NC=CN1CC(=O)NC2=CC=CC(=C2)C(=S)N

DOS

IR

Vibrations