Geometry & MOs

Info

ID:	216105
PubChem CID:	85085740
Reduced:	ON2C14H16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	228.172545
ΔH_f, kcal/mol:	36.74
Dipole, Da:	6.64
IP(EA), eV:	-8.4(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyethoxy)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Drug info:

PubChemData

Smile

CN(C)C=CC=C(C#N)C1=CC(=CC=C1)OC

DOS

IR

Vibrations