Geometry & MOs

Info

ID:	5087
PubChem CID:	12568
Reduced:	O4H8C9 (1)
Stoich.:	A4B8C9 (1)
Weight, g/mol:	180.042259
ΔH_f, kcal/mol:	-74.94
Dipole, Da:	1.78
IP(EA), eV:	-10.24(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetyl benzenecarboperoxoate

Drug info:

PubChemData

Smile

CC(=O)OOC(=O)C1=CC=CC=C1

DOS

IR

Vibrations