Geometry & MOs

Info

ID:	146002
PubChem CID:	53623672
Reduced:	Cl2N2O3C13H22 (1)
Stoich.:	A2B2C3D13E22 (1)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-173.19
Dipole, Da:	2.92
IP(EA), eV:	-9.91(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[2-[benzyl(methyl)amino]ethyl]piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1(CC1(Cl)Cl)C(=O)NCCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations