Geometry & MOs

Info

ID:	6414
PubChem CID:	68558
Reduced:	O6H12C17 (1)
Stoich.:	A6B12C17 (1)
Weight, g/mol:	312.063388
ΔH_f, kcal/mol:	-186.76
Dipole, Da:	5.84
IP(EA), eV:	-9.82(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-oxo-1H-2-benzofuran-1-yl) 2-acetyloxybenzoate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC=C1C(=O)OC2C3=CC=CC=C3C(=O)O2

DOS

IR

Vibrations