Geometry & MOs

Info

ID:	354977
PubChem CID:	127287838
Reduced:	N3O5C19H25 (1)
Stoich.:	A3B5C19D25 (1)
Weight, g/mol:	296.184841
ΔH_f, kcal/mol:	-200.25
Dipole, Da:	4.83
IP(EA), eV:	-9.11(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-4-[(2R)-5-oxopyrrolidine-2-carbonyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)N2CCC(CC2)NC(=O)[C@H]3CCC(=O)N3)OC

DOS

IR

Vibrations