Geometry & MOs

Info

ID:	129210
PubChem CID:	51071944
Reduced:	FO3N4C17H23 (1)
Stoich.:	AB3C4D17E23 (1)
Weight, g/mol:	351.159434
ΔH_f, kcal/mol:	-156.95
Dipole, Da:	6.35
IP(EA), eV:	-9.72(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[2-[(4-fluorobenzoyl)amino]ethyl]-1-(2-methoxyacetyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations