Geometry & MOs

Info

ID:	38640
PubChem CID:	8137318
Reduced:	FSN3O3C15H18 (1)
Stoich.:	ABC3D3E15F18 (1)
Weight, g/mol:	345.11765
ΔH_f, kcal/mol:	-135.48
Dipole, Da:	1.6
IP(EA), eV:	-9.17(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl] 3,4-difluorobenzoate

Drug info:

PubChemData

Smile

C1CC1NC(=O)CNC(=O)CSCC(=O)NC2=CC=CC=C2F

DOS

IR

Vibrations