Geometry & MOs

Info

ID:	381817
PubChem CID:	134972652
Reduced:	O4C15H24 (1)
Stoich.:	A4B15C24 (1)
Weight, g/mol:	222.019809
ΔH_f, kcal/mol:	-181.13
Dipole, Da:	1.98
IP(EA), eV:	-9.52(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[(1S)-1-hydroxyethyl]-5-oxo-2H-furan-4-yl] methanesulfonate

Drug info:

PubChemData

Smile

C/C(=C\COC1CCCCO1)/CC/C=C/C(=O)OC

DOS

IR

Vibrations