Geometry & MOs

Info

ID:	241685
PubChem CID:	96024006
Reduced:	NC20H23 (1)
Stoich.:	AB20C23 (1)
Weight, g/mol:	281.157978
ΔH_f, kcal/mol:	29.49
Dipole, Da:	1.99
IP(EA), eV:	-8.8(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations