Geometry & MOs

Info

ID:	293582
PubChem CID:	117393890
Reduced:	FO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	256.111087
ΔH_f, kcal/mol:	-201.94
Dipole, Da:	4.09
IP(EA), eV:	-8.85(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(5-fluoro-3-methoxy-2-propan-2-ylphenyl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

COCC1=CC(=C(C(=C1)F)OC)CCCC(=O)O

DOS

IR

Vibrations