Geometry & MOs

Info

ID:	290492
PubChem CID:	104638208
Reduced:	ClFN2O3H8C13 (1)
Stoich.:	ABC2D3E8F13 (1)
Weight, g/mol:	240.09102
ΔH_f, kcal/mol:	-118.93
Dipole, Da:	8.46
IP(EA), eV:	-9.76(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-fluoropyridine-2-carbonyl)amino]-2,2-dimethylpropanoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=NC=C(C=C2)F)Cl)C(=O)O

DOS

IR

Vibrations