Geometry & MOs

Info

ID:	448784
PubChem CID:	135293591
Reduced:	FON2H9C13 (1)
Stoich.:	ABC2D9E13 (1)
Weight, g/mol:	389.176422
ΔH_f, kcal/mol:	-5.09
Dipole, Da:	4.75
IP(EA), eV:	-10.06(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-[(3S)-3-fluoropiperidin-1-yl]pyridin-2-yl]-6-(6-methylpyrazin-2-yl)pyrazolo[4,3-c]pyridine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C2=CN=CC(=C2)CO)F)C#N

DOS

IR

Vibrations