Geometry & MOs

Info

ID:	261245
PubChem CID:	103224076
Reduced:	O5C9H16 (1)
Stoich.:	A5B9C16 (1)
Weight, g/mol:	259.049215
ΔH_f, kcal/mol:	-220.67
Dipole, Da:	2.19
IP(EA), eV:	-9.98(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluoro-2-nitrophenoxy)-3-methoxypropanoic acid

Drug info:

PubChemData

Smile

COCC(C(=O)O)OCC1CCOC1

DOS

IR

Vibrations