Geometry & MOs

Info

ID:	27961
PubChem CID:	824341
Reduced:	FN2O2C19H19 (1)
Stoich.:	AB2C2D19E19 (1)
Weight, g/mol:	326.143056
ΔH_f, kcal/mol:	-93.81
Dipole, Da:	7.14
IP(EA), eV:	-8.84(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(4-fluorophenyl)-5-oxo-N-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)F

DOS

IR

Vibrations