Geometry & MOs

Info

ID:	355683
PubChem CID:	127289664
Reduced:	O3N4C22H30 (1)
Stoich.:	A3B4C22D30 (1)
Weight, g/mol:	365.24269
ΔH_f, kcal/mol:	-76.48
Dipole, Da:	6.33
IP(EA), eV:	-8.7(-0.78)
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]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CN2CCC(CC2)N(C)C(=O)C3=CC4=CC=CC=C4O3

DOS

IR

Vibrations