Geometry & MOs

Info

ID:	355020
PubChem CID:	127287881
Reduced:	O2N5C14H19 (1)
Stoich.:	A2B5C14D19 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-55.48
Dipole, Da:	1.79
IP(EA), eV:	-8.89(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-methyl-4-[(2R)-5-oxopyrrolidine-2-carbonyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C2=NC=CC=N2)NC(=O)[C@H]3CCC(=O)N3

DOS

IR

Vibrations