Geometry & MOs

Info

ID:	241618
PubChem CID:	96023843
Reduced:	FNC18H20 (1)
Stoich.:	ABC18D20 (1)
Weight, g/mol:	269.157978
ΔH_f, kcal/mol:	-23.63
Dipole, Da:	2.28
IP(EA), eV:	-8.75(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C2=C(CCN[C@H]2CC3=CC=CC=C3F)C=C1)C

DOS

IR

Vibrations