Geometry & MOs

Info

ID:	62481
PubChem CID:	26719776
Reduced:	ClFN2O4H18C19 (1)
Stoich.:	ABC2D4E18F19 (1)
Weight, g/mol:	366.08497
ΔH_f, kcal/mol:	-169.45
Dipole, Da:	10.86
IP(EA), eV:	-8.32(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3-fluorophenyl)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1N2C[C@@H](CC2=O)C(=O)NC3=CC(=CC=C3)F)Cl)OC

DOS

IR

Vibrations