Geometry & MOs

Info

ID:	359062
PubChem CID:	127297306
Reduced:	F2N6C19H22 (1)
Stoich.:	A2B6C19D22 (1)
Weight, g/mol:	325.146013
ΔH_f, kcal/mol:	5.93
Dipole, Da:	5.25
IP(EA), eV:	-8.93(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-3-piperidin-1-ylsulfonylpyridin-2-amine

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CN2CCCN(CC2)C3=NC(=NC4=CC=CC=C43)C(F)F

DOS

IR

Vibrations