Geometry & MOs

Info

ID:	332188
PubChem CID:	127250474
Reduced:	O3N4H20C22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	391.131425
ΔH_f, kcal/mol:	-25.22
Dipole, Da:	2.6
IP(EA), eV:	-9.33(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-morpholin-4-ylsulfonyl-2-(6-pyrimidin-5-ylpyridin-2-yl)morpholine

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CC=CC=N2)C3=CC=CC(=N3)C4=CC(=CC=C4)C(=O)N

DOS

IR

Vibrations