Geometry & MOs

Info

ID:	405800
PubChem CID:	135075462
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	154.135765
ΔH_f, kcal/mol:	-28.9
Dipole, Da:	2.53
IP(EA), eV:	-8.55(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5S)-2-methylbicyclo[3.3.1]nonan-1-ol

Drug info:

PubChemData

Smile

C[C@H]1CCCN1CC2=CC=C(C=C2)OC

DOS

IR

Vibrations