Geometry & MOs

Info

ID:	203090
PubChem CID:	79777254
Reduced:	N2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	406.8818
ΔH_f, kcal/mol:	-109.34
Dipole, Da:	3.06
IP(EA), eV:	-8.97(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-bromo-2-fluorophenyl)methyl]-5-iodopyridin-2-one

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations