Geometry & MOs

Info

ID:	349021
PubChem CID:	127274747
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	398.268176
ΔH_f, kcal/mol:	-75.56
Dipole, Da:	6.1
IP(EA), eV:	-8.85(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-1-N-benzyl-1-N-methylpiperidine-1,4-dicarboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1CCN2C1CCCC2)NC(=O)C3=CC=CC=N3

DOS

IR

Vibrations