Geometry & MOs

Info

ID:	256905
PubChem CID:	103142295
Reduced:	NO2C14H27 (1)
Stoich.:	AB2C14D27 (1)
Weight, g/mol:	261.220498
ΔH_f, kcal/mol:	-137.98
Dipole, Da:	1.6
IP(EA), eV:	-9.03(2.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-N'-propyl-N'-(1,2,3,4-tetrahydroisoquinolin-8-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2(CCC(C2O)(C)C)CN

DOS

IR

Vibrations