Geometry & MOs

Info

ID:	403836
PubChem CID:	135062078
Reduced:	FNC10H12 (1)
Stoich.:	ABC10D12 (1)
Weight, g/mol:	255.142328
ΔH_f, kcal/mol:	-33.75
Dipole, Da:	1.55
IP(EA), eV:	-9.34(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-4-fluoro-3-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

C[C@@H]1[C@@H](C2=CC=CC=C2CN1)F

DOS

IR

Vibrations