Geometry & MOs

Info

ID:	226255
PubChem CID:	87350239
Reduced:	NH8C17F21 (1)
Stoich.:	AB8C17D21 (1)
Weight, g/mol:	146.13068
ΔH_f, kcal/mol:	-1010.08
Dipole, Da:	4.85
IP(EA), eV:	-9.87(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-3-methylperoxypentane

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

DOS

IR

Vibrations