Geometry & MOs

Info

ID:	206541
PubChem CID:	80267023
Reduced:	FNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	283.085601
ΔH_f, kcal/mol:	-187.63
Dipole, Da:	8.2
IP(EA), eV:	-9.92(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-fluoro-4-methylbenzoyl)amino]pentanedioic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NC(C)(C)C(C)(C)C(=O)O)F

DOS

IR

Vibrations