Geometry & MOs

Info

ID:	241346
PubChem CID:	96023259
Reduced:	FN2O2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	297.152892
ΔH_f, kcal/mol:	-87.82
Dipole, Da:	5.84
IP(EA), eV:	-8.99(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-8-fluoro-1-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CN[C@H](C2=CC(=C(C=C21)F)O)C3=CC(=O)NC=C3

DOS

IR

Vibrations