Geometry & MOs

Info

ID:	256920
PubChem CID:	103142426
Reduced:	O2C11H20 (1)
Stoich.:	A2B11C20 (1)
Weight, g/mol:	260.188863
ΔH_f, kcal/mol:	-115.93
Dipole, Da:	4.07
IP(EA), eV:	-9.71(2.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(oxan-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-8-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2(CCC2)CO

DOS

IR

Vibrations