Geometry & MOs

Info

ID:	241154
PubChem CID:	96021558
Reduced:	NF2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	279.1987
ΔH_f, kcal/mol:	-47.17
Dipole, Da:	2.44
IP(EA), eV:	-9.09(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-8-methyl-1-[(2,4,6-trimethylphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)[C@H](NCC2)/C=C/C3=C(C=CC(=C3)F)F

DOS

IR

Vibrations