Geometry & MOs

Info

ID:	368856
PubChem CID:	127330816
Reduced:	ON8C20H30 (1)
Stoich.:	AB8C20D30 (1)
Weight, g/mol:	359.268511
ΔH_f, kcal/mol:	24.98
Dipole, Da:	5.89
IP(EA), eV:	-8.55(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(CN1CCN(CC1)C2=CC=CC=N2)NC(=O)NC(C)C3=NN=C4N3CCC4

DOS

IR

Vibrations