Geometry & MOs

Info

ID:	357081
PubChem CID:	127293150
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	399.215806
ΔH_f, kcal/mol:	-60.52
Dipole, Da:	1.76
IP(EA), eV:	-8.92(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations