Geometry & MOs

Info

ID:	269720
PubChem CID:	103618805
Reduced:	O3N4C14H22 (1)
Stoich.:	A3B4C14D22 (1)
Weight, g/mol:	463.95964
ΔH_f, kcal/mol:	-94.02
Dipole, Da:	2.4
IP(EA), eV:	-8.87(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-iodo-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide

Drug info:

PubChemData

Smile

COCCOCC(=O)NC1CCCN(C1)C2=NC=CC=N2

DOS

IR

Vibrations