Geometry & MOs

Info

ID:	13411
PubChem CID:	229578
Reduced:	O9H24C28 (1)
Stoich.:	A9B24C28 (1)
Weight, g/mol:	504.142032
ΔH_f, kcal/mol:	-299.9
Dipole, Da:	5.68
IP(EA), eV:	-10.12(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-acetyloxy-3,4-dibenzoyloxyoxolan-2-yl)methyl benzoate

Drug info:

PubChemData

Smile

CC(=O)OC1C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations