Geometry & MOs

Info

ID:	255542
PubChem CID:	103132828
Reduced:	FNOH10C15 (1)
Stoich.:	ABCD10E15 (1)
Weight, g/mol:	202.090627
ΔH_f, kcal/mol:	-20.45
Dipole, Da:	3.83
IP(EA), eV:	-9.38(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-fluoroazetidin-3-yl)isoquinoline

Drug info:

PubChemData

Smile

C1=CC2=C(C=NC=C2)C(=C1)C3=CC(=CC(=C3)F)O

DOS

IR

Vibrations