Geometry & MOs

Info

ID:	21207
PubChem CID:	587665
Reduced:	O5C11H12 (1)
Stoich.:	A5B11C12 (1)
Weight, g/mol:	224.068473
ΔH_f, kcal/mol:	-200.03
Dipole, Da:	5.45
IP(EA), eV:	-9.53(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-acetyloxy-5-(hydroxymethyl)phenyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC(=CC(=C1)CO)OC(=O)C

DOS

IR

Vibrations