Geometry & MOs

Info

ID:	201416
PubChem CID:	79537151
Reduced:	ClSN4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	291.267448
ΔH_f, kcal/mol:	52.54
Dipole, Da:	5.44
IP(EA), eV:	-8.06(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)-9-azabicyclo[3.3.1]nonan-3-amine

Drug info:

PubChemData

Smile

C1CC(C(C1)NC2=C(C=CC3=NSN=C32)Cl)C4CCCN4

DOS

IR

Vibrations