Geometry & MOs

Info

ID:	69742
PubChem CID:	47205312
Reduced:	O3N4C12H14 (1)
Stoich.:	A3B4C12D14 (1)
Weight, g/mol:	342.03792
ΔH_f, kcal/mol:	-45.92
Dipole, Da:	3.38
IP(EA), eV:	-9.65(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-fluoro-N-(2-oxo-2-piperidin-1-ylethyl)benzamide

Drug info:

PubChemData

Smile

CN(CC(=O)NCC1=CC=NN1)C(=O)C2=CC=CO2

DOS

IR

Vibrations