Geometry & MOs

Info

ID:	241673
PubChem CID:	96023969
Reduced:	NOC19H21 (1)
Stoich.:	ABC19D21 (1)
Weight, g/mol:	285.152892
ΔH_f, kcal/mol:	-5.29
Dipole, Da:	3.9
IP(EA), eV:	-8.79(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[(4-fluorophenoxy)methyl]-7,8-dimethyl-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

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CC1=CC2=C(C=C1C)[C@@H](NCC2)/C=C/C3=CC=C(C=C3)O

DOS

IR

Vibrations