Geometry & MOs

Info

ID:	241181
PubChem CID:	96021794
Reduced:	NOF2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	289.12782
ΔH_f, kcal/mol:	-78.74
Dipole, Da:	3.87
IP(EA), eV:	-8.7(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(1R)-6,8-difluoro-1,2,3,4-tetrahydroisoquinolin-1-yl]-2-phenylethanol

Drug info:

PubChemData

Smile

C1CN[C@@H](C2=C1C=C(C=C2F)F)/C=C/C3=CC=C(C=C3)O

DOS

IR

Vibrations