Geometry & MOs

Info

ID:	355681
PubChem CID:	127289662
Reduced:	O3N5C20H33 (1)
Stoich.:	A3B5C20D33 (1)
Weight, g/mol:	366.263091
ΔH_f, kcal/mol:	-94.81
Dipole, Da:	1.6
IP(EA), eV:	-8.67(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidin-4-yl]oxane-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CC(=O)N(C)C2CCN(CC2)CC(=O)N3CCN(CC3)C

DOS

IR

Vibrations