Geometry & MOs

Info

ID:	129183
PubChem CID:	51071884
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-121.28
Dipole, Da:	5.67
IP(EA), eV:	-9.16(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-benzamidoethyl)-1-butanoylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC[C@H]1C(=O)NCCNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations