Geometry & MOs

Info

ID:	157116
PubChem CID:	56422154
Reduced:	ClN3O3C19H22 (1)
Stoich.:	AB3C3D19E22 (1)
Weight, g/mol:	310.189257
ΔH_f, kcal/mol:	-81.15
Dipole, Da:	3.63
IP(EA), eV:	-9.25(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(1,3-dioxolan-2-yl)piperidine-1-carbonyl]-1-propan-2-ylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCCCC3C4OCCO4

DOS

IR

Vibrations