Geometry & MOs

Info

ID:	22305
PubChem CID:	596569
Reduced:	O2C13H20 (1)
Stoich.:	A2B13C20 (1)
Weight, g/mol:	208.14633
ΔH_f, kcal/mol:	-106.6
Dipole, Da:	3.56
IP(EA), eV:	-9.73(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-1,4,8,8-tetramethylbicyclo[3.3.1]non-2-en-9-one

Drug info:

PubChemData

Smile

CC1(CCC2C(=O)C1(C=CC2(C)O)C)C

DOS

IR

Vibrations