Geometry & MOs

Info

ID:	362883
PubChem CID:	127309712
Reduced:	ClO2N4C18H23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	376.166604
ΔH_f, kcal/mol:	-46.19
Dipole, Da:	3.0
IP(EA), eV:	-8.84(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-chlorophenyl)-2-oxopyrrolidin-3-yl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCN(CC2)C(=O)NC3CCN(C3=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations