Geometry & MOs

Info

ID:	274382
PubChem CID:	103808936
Reduced:	BrON2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-23.08
Dipole, Da:	3.05
IP(EA), eV:	-9.16(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3-oxo-3-piperidin-1-ylpropyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)Br)C(=O)[C@@H]2CCCCN2

DOS

IR

Vibrations