Geometry & MOs

Info

ID:	412167
PubChem CID:	135085041
Reduced:	YO2C5H9 (1)
Stoich.:	AB2C5D9 (1)
Weight, g/mol:	236.104859
ΔH_f, kcal/mol:	-57.85
Dipole, Da:	2.08
IP(EA), eV:	-5.9(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 5-hydroxyoxane-2-carboxylate

Drug info:

PubChemData

Smile

C1CC(CO[CH-]1)O.[Y]

DOS

IR

Vibrations