Geometry & MOs

Info

ID:	355084
PubChem CID:	127287945
Reduced:	ClN2O2C14H15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-84.55
Dipole, Da:	3.43
IP(EA), eV:	-9.51(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N[C@H]1C(=O)NC2CCC3=C2C=CC(=C3)Cl

DOS

IR

Vibrations