Geometry & MOs

Info

ID:	340357
PubChem CID:	127262368
Reduced:	O2C9H16 (1)
Stoich.:	A2B9C16 (1)
Weight, g/mol:	172.14633
ΔH_f, kcal/mol:	-86.21
Dipole, Da:	3.16
IP(EA), eV:	-8.79(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-hydroperoxy-2-methylpropyl)cyclohexane

Drug info:

PubChemData

Smile

CO/C=C\1/CCCCC1OC

DOS

IR

Vibrations