Geometry & MOs

Info

ID:	353568
PubChem CID:	127285145
Reduced:	O2N3C9H12 (2)
Stoich.:	A2B3C9D12 (2)
Weight, g/mol:	398.195405
ΔH_f, kcal/mol:	-141.21
Dipole, Da:	7.78
IP(EA), eV:	-9.36(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-oxo-2,4-dihydroquinoxalin-1-yl)-4-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]butane-1,4-dione

Drug info:

PubChemData

Smile

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)N3CCC(CC3)N4CCCC4=O

DOS

IR

Vibrations