Geometry & MOs

Info

ID:	314921
PubChem CID:	126623969
Reduced:	BrOCl2N3C12H18 (1)
Stoich.:	ABC2D3E12F18 (1)
Weight, g/mol:	297.04767
ΔH_f, kcal/mol:	-107.41
Dipole, Da:	10.97
IP(EA), eV:	-9.97(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(6-bromopyridin-2-yl)methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1C[C@H](CNC1)C(=O)NCC2=NC(=CC=C2)Br.Cl.Cl

DOS

IR

Vibrations