Geometry & MOs

Info

ID:	347001
PubChem CID:	127271505
Reduced:	ON6C16H22 (1)
Stoich.:	AB6C16D22 (1)
Weight, g/mol:	329.196408
ΔH_f, kcal/mol:	24.94
Dipole, Da:	3.52
IP(EA), eV:	-9.46(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-imidazol-2-yl)-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN(CCC1=CC=NC=C1)C(=O)NCC2=NN=C3N2CCCC3

DOS

IR

Vibrations