Geometry & MOs

Info

ID:	226803
PubChem CID:	87558413
Reduced:	O2C25H40 (1)
Stoich.:	A2B25C40 (1)
Weight, g/mol:	422.266839
ΔH_f, kcal/mol:	-69.15
Dipole, Da:	3.49
IP(EA), eV:	-8.32(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(2,4,4-trimethylpentan-2-yl) benzene-1,4-dicarboperoxoate

Drug info:

PubChemData

Smile

CCCCCCCCCC/C=C/C=C\C=C/C=C/C=C/C(=C/O)/OCCC

DOS

IR

Vibrations