Geometry & MOs

Info

ID:	379422
PubChem CID:	134419401
Reduced:	O3C14H22 (1)
Stoich.:	A3B14C22 (1)
Weight, g/mol:	392.29266
ΔH_f, kcal/mol:	-148.84
Dipole, Da:	1.96
IP(EA), eV:	-10.15(1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,2-dimethylpropyl)-6-[[5-(2,2-dimethylpropyl)-2,6-dihydroxy-2-bicyclo[2.2.1]heptanyl]oxy]bicyclo[2.2.1]heptan-2-one

Drug info:

PubChemData

Smile

C1CC2CC1CC2OC3(CC4CC3C(C4)O)O

DOS

IR

Vibrations