Geometry & MOs

Info

ID:	52716
PubChem CID:	12015760
Reduced:	NOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	169.146664
ΔH_f, kcal/mol:	-76.04
Dipole, Da:	3.5
IP(EA), eV:	-9.01(2.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4aS,8R,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-yl]methanol

Drug info:

PubChemData

Smile

C1C[C@@H]2CCCN[C@@H]2[C@H](C1)CO

DOS

IR

Vibrations