Geometry & MOs

Info

ID:	54974
PubChem CID:	17389609
Reduced:	ClNF3O3H9C12 (1)
Stoich.:	ABC3D3E9F12 (1)
Weight, g/mol:	362.89287
ΔH_f, kcal/mol:	-273.96
Dipole, Da:	7.01
IP(EA), eV:	-9.34(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dibromophenyl)-5-oxopyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1C(CN(C1=O)C2=CC(=C(C=C2)Cl)C(F)(F)F)C(=O)O

DOS

IR

Vibrations