Geometry & MOs

Info

ID:	389938
PubChem CID:	134996114
Reduced:	OC15H24 (1)
Stoich.:	AB15C24 (1)
Weight, g/mol:	130.09938
ΔH_f, kcal/mol:	-34.05
Dipole, Da:	1.3
IP(EA), eV:	-9.59(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-1-hydroperoxy-2-methylcyclohexane

Drug info:

PubChemData

Smile

CCCCC#C[C@H]1C=CC[C@@H](O1)CCCC

DOS

IR

Vibrations