Geometry & MOs

Info

ID:	355227
PubChem CID:	127288159
Reduced:	O3N4C13H22 (1)
Stoich.:	A3B4C13D22 (1)
Weight, g/mol:	296.221226
ΔH_f, kcal/mol:	-139.97
Dipole, Da:	1.48
IP(EA), eV:	-8.8(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CCNC(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations