Geometry & MOs

Info

ID:	18383
PubChem CID:	540050
Reduced:	O5C13H14 (2)
Stoich.:	A5B13C14 (2)
Weight, g/mol:	500.168247
ΔH_f, kcal/mol:	-398.71
Dipole, Da:	3.19
IP(EA), eV:	-8.93(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4,5-triacetyloxy-6-(4-phenylphenoxy)oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)OC2=CC=C(C=C2)C3=CC=CC=C3)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations