Geometry & MOs

Info

ID:	389875
PubChem CID:	134995706
Reduced:	O2C3H6 (2)
Stoich.:	A2B3C6 (2)
Weight, g/mol:	168.11503
ΔH_f, kcal/mol:	-131.93
Dipole, Da:	1.11
IP(EA), eV:	-9.89(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,4R)-2-hydroperoxy-7,7-dimethyl-3-methylidenebicyclo[2.2.1]heptane

Drug info:

PubChemData

Smile

CCOC(=O)CC(C)OO

DOS

IR

Vibrations