Geometry & MOs

Info

ID:	399077
PubChem CID:	135037531
Reduced:	O3C11H16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	258.110338
ΔH_f, kcal/mol:	-125.94
Dipole, Da:	3.94
IP(EA), eV:	-10.29(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,6S)-3-acetyloxy-6-ethoxy-3,6-dihydro-2H-pyran-2-yl]methyl acetate

Drug info:

PubChemData

Smile

C=CCOC(=O)C1CCCCCC1=O

DOS

IR

Vibrations