Geometry & MOs

Info

ID:	5031
PubChem CID:	12479
Reduced:	O2C5H5 (2)
Stoich.:	A2B5C5 (2)
Weight, g/mol:	194.057909
ΔH_f, kcal/mol:	-145.99
Dipole, Da:	3.48
IP(EA), eV:	-9.18(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-acetyloxyphenyl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC=C1OC(=O)C

DOS

IR

Vibrations