Geometry & MOs

Info

ID:	305751
PubChem CID:	124967900
Reduced:	FON3C20H26 (1)
Stoich.:	ABC3D20E26 (1)
Weight, g/mol:	446.206639
ΔH_f, kcal/mol:	-57.18
Dipole, Da:	3.51
IP(EA), eV:	-9.1(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-5-[6-[(2S)-4-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]morpholin-2-yl]pyridin-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCC3(CC2)C[C@H](OC3)CC4=CC(=CC=C4)F

DOS

IR

Vibrations