Geometry & MOs

Info

ID:	52113
PubChem CID:	12014898
Reduced:	O7C14H24 (1)
Stoich.:	A7B14C24 (1)
Weight, g/mol:	246.146724
ΔH_f, kcal/mol:	-353.28
Dipole, Da:	2.65
IP(EA), eV:	-9.86(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2-hydroxy-2-[(2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]ethyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC[C@@H]([C@@]1(CC[C@@H](O1)[C@@](C)(COC(=O)C)O)C)O

DOS

IR

Vibrations