Geometry & MOs

Info

ID:	51985
PubChem CID:	12014756
Reduced:	O3C8H10 (1)
Stoich.:	A3B8C10 (1)
Weight, g/mol:	318.204239
ΔH_f, kcal/mol:	-93.23
Dipole, Da:	2.38
IP(EA), eV:	-10.15(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-2,5-bis(tert-butylperoxy)-5-methylhex-3-enoate

Drug info:

PubChemData

Smile

C/C(=C\C=C\C(=O)OC)/C=O

DOS

IR

Vibrations