Geometry & MOs

Info

ID:	359335
PubChem CID:	127298384
Reduced:	O3N4C22H28 (1)
Stoich.:	A3B4C22D28 (1)
Weight, g/mol:	337.236542
ΔH_f, kcal/mol:	-75.61
Dipole, Da:	5.06
IP(EA), eV:	-8.88(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylpiperazin-1-yl)-2-[1-[2-(oxolan-2-yl)acetyl]piperidin-4-yl]ethanone

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CC2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CN=CO4

DOS

IR

Vibrations