Geometry & MOs

Info

ID:	13557
PubChem CID:	301135
Reduced:	O2C9H14 (1)
Stoich.:	A2B9C14 (1)
Weight, g/mol:	154.09938
ΔH_f, kcal/mol:	-110.37
Dipole, Da:	4.22
IP(EA), eV:	-9.85(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-1-methylbicyclo[2.2.2]octan-2-one

Drug info:

PubChemData

Smile

CC12CCC(CC1)(CC2=O)O

DOS

IR

Vibrations