Geometry & MOs

Info

ID:	257165
PubChem CID:	103144141
Reduced:	NC18H21 (1)
Stoich.:	AB18C21 (1)
Weight, g/mol:	265.18305
ΔH_f, kcal/mol:	10.79
Dipole, Da:	1.01
IP(EA), eV:	-8.98(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[3-(2-methylpropyl)phenyl]-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C2=CC=CC3=C2CNCC3)C

DOS

IR

Vibrations