Geometry & MOs

Info

ID:	398843
PubChem CID:	135035708
Reduced:	ClMgOC5H11 (1)
Stoich.:	ABCD5E11 (1)
Weight, g/mol:	167.094629
ΔH_f, kcal/mol:	-83.92
Dipole, Da:	6.68
IP(EA), eV:	-9.54(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-2-hydroxy-6-methyl-8-methylidene-2-azabicyclo[3.2.1]octan-3-one

Drug info:

PubChemData

Smile

CC([CH2-])COC.[Mg+2].[Cl-]

DOS

IR

Vibrations