Geometry & MOs

Info

ID:	288484
PubChem CID:	104317239
Reduced:	ON3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	226.204513
ΔH_f, kcal/mol:	-36.59
Dipole, Da:	2.88
IP(EA), eV:	-9.11(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]butan-2-ol

Drug info:

PubChemData

Smile

CC(CCNCCC1=NC=CN1C)O

DOS

IR

Vibrations