Geometry & MOs

Info

ID:	261651
PubChem CID:	103243627
Reduced:	FNO2C11H12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-99.81
Dipole, Da:	3.13
IP(EA), eV:	-8.9(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[(5-methyl-1,2-oxazol-3-yl)methylamino]methyl]phenyl]propanoic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1F)NC/C=C/C(=O)O

DOS

IR

Vibrations