Geometry & MOs

Info

ID:	45483
PubChem CID:	10514060
Reduced:	O5C12H14 (1)
Stoich.:	A5B12C14 (1)
Weight, g/mol:	238.084124
ΔH_f, kcal/mol:	-218.26
Dipole, Da:	5.24
IP(EA), eV:	-10.67(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-3-[(2R)-5-methyl-3,6-dihydro-2H-pyran-2-yl]-5-oxo-2H-furan-2-yl] acetate

Drug info:

PubChemData

Smile

COC(=O)[C@]12CC(=O)C[C@H]1C[C@H]3[C@@H]2COC3=O

DOS

IR

Vibrations