Geometry & MOs

Info

ID:	256938
PubChem CID:	103142521
Reduced:	N3O3C15H19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	272.225249
ΔH_f, kcal/mol:	-15.42
Dipole, Da:	6.92
IP(EA), eV:	-9.27(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroisoquinolin-8-amine

Drug info:

PubChemData

Smile

CCCCN(CCO)C1=C2C=NC=CC2=C(C=C1)[N+](=O)[O-]

DOS

IR

Vibrations