Geometry & MOs

Info

ID:	208147
PubChem CID:	80501719
Reduced:	BrON4H13C14 (1)
Stoich.:	ABC4D13E14 (1)
Weight, g/mol:	313.98663
ΔH_f, kcal/mol:	45.79
Dipole, Da:	6.54
IP(EA), eV:	-8.42(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-3-bromo-1-[(2,3-difluorophenyl)methyl]pyridin-2-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)CN3C=C(C=C(C3=O)Br)N

DOS

IR

Vibrations