Geometry & MOs

Info

ID:	52112
PubChem CID:	12014897
Reduced:	O3C10H18 (1)
Stoich.:	A3B10C18 (1)
Weight, g/mol:	304.152203
ΔH_f, kcal/mol:	-162.74
Dipole, Da:	3.42
IP(EA), eV:	-9.8(1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2-[(2S,5R)-5-[(2R)-1-acetyloxy-2-hydroxypropan-2-yl]-2-methyloxolan-2-yl]-2-hydroxyethyl] acetate

Drug info:

PubChemData

Smile

C[C@]1(CC[C@H]2C[C@@H]1O[C@@]2(C)CO)O

DOS

IR

Vibrations