Geometry & MOs

Info

ID:	241320
PubChem CID:	96022722
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-90.3
Dipole, Da:	2.35
IP(EA), eV:	-9.07(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-6-fluoro-1-[(1R)-2-hydroxy-1-phenylethyl]-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

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

DOS

IR

Vibrations