Geometry & MOs

Info

ID:	340563
PubChem CID:	127262574
Reduced:	BClNO2C16H21 (1)
Stoich.:	ABCD2E16F21 (1)
Weight, g/mol:	252.059632
ΔH_f, kcal/mol:	-180.27
Dipole, Da:	3.04
IP(EA), eV:	-8.23(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-5-piperidin-4-ylpyridine;dihydrochloride

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C=C(C=C3)N.Cl

DOS

IR

Vibrations