Geometry & MOs

Info

ID:	241704
PubChem CID:	96024049
Reduced:	NF2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	287.148556
ΔH_f, kcal/mol:	-75.59
Dipole, Da:	4.2
IP(EA), eV:	-8.89(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(2,4-difluorophenyl)methyl]-6,7-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations