Geometry & MOs

Info

ID:	233399
PubChem CID:	89855742
Reduced:	ClFN4O5H22C26 (1)
Stoich.:	ABC4D5E22F26 (1)
Weight, g/mol:	419.104812
ΔH_f, kcal/mol:	-190.47
Dipole, Da:	1.75
IP(EA), eV:	-9.26(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(3-chloro-5-fluorophenyl)methyl]-3-hydroxy-1-[3-(methylcarbamoyl)phenyl]-2-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(C(=O)C1(C(=O)NCC2=CC(=CC(=C2)Cl)F)O)C3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(=O)N

DOS

IR

Vibrations