Geometry & MOs

Info

ID:	200227
PubChem CID:	79366186
Reduced:	FO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	256.111087
ΔH_f, kcal/mol:	-226.27
Dipole, Da:	1.57
IP(EA), eV:	-10.57(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-fluoro-3-hydroxy-3-(4-methoxyphenyl)butanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1(CC(CC(C1)C)C)O)F

DOS

IR

Vibrations