Geometry & MOs

Info

ID:	337975
PubChem CID:	127258598
Reduced:	FNO3C9H16 (1)
Stoich.:	ABC3D9E16 (1)
Weight, g/mol:	233.089937
ΔH_f, kcal/mol:	-158.57
Dipole, Da:	1.32
IP(EA), eV:	-9.89(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-carboxypropan-2-yl(hydroxy)carbamoyl]butanoic acid

Drug info:

PubChemData

Smile

CCCC(=O)OCC(/C=N/OCC)F

DOS

IR

Vibrations