Geometry & MOs

Info

ID:	242040
PubChem CID:	96025203
Reduced:	NF2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	279.1987
ΔH_f, kcal/mol:	-78.15
Dipole, Da:	2.74
IP(EA), eV:	-8.9(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(2,5-dimethylphenyl)methyl]-7,8-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)[C@H](NCC2)CC3=CC(=CC(=C3)F)F

DOS

IR

Vibrations