Geometry & MOs

Info

ID:	331622
PubChem CID:	127249705
Reduced:	ON5C22H27 (1)
Stoich.:	AB5C22D27 (1)
Weight, g/mol:	395.232125
ΔH_f, kcal/mol:	50.8
Dipole, Da:	3.39
IP(EA), eV:	-8.04(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[6-[(6-methylpyridin-2-yl)amino]pyridin-2-yl]morpholin-4-yl]-1-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

CC1=CC(=NN1C)NC2=CC=CC(=N2)C3CN(CCO3)CCC4=CC=CC=C4

DOS

IR

Vibrations