Geometry & MOs

Info

ID:	294480
PubChem CID:	117463279
Reduced:	NOF6C11H11 (1)
Stoich.:	ABC6D11E11 (1)
Weight, g/mol:	287.096914
ΔH_f, kcal/mol:	-351.03
Dipole, Da:	2.92
IP(EA), eV:	-9.96(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4,6-difluoro-2,3-dimethoxyphenyl)pyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations