Geometry & MOs

Info

ID:	333796
PubChem CID:	127252348
Reduced:	O2N5C20H21 (1)
Stoich.:	A2B5C20D21 (1)
Weight, g/mol:	406.17871
ΔH_f, kcal/mol:	17.28
Dipole, Da:	4.77
IP(EA), eV:	-8.25(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1H-pyrazol-3-yl)-6-(4-piperidin-1-ylsulfonylmorpholin-2-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NN1)NC2=CC=CC(=N2)C3CN(CCO3)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations