Geometry & MOs

Info

ID:	332400
PubChem CID:	127250686
Reduced:	ON3C11H11 (2)
Stoich.:	AB3C11D11 (2)
Weight, g/mol:	368.159689
ΔH_f, kcal/mol:	47.36
Dipole, Da:	3.54
IP(EA), eV:	-8.75(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methyl-1,2,5-oxadiazol-3-yl)-1-[2-[5-(1-methylpyrazol-4-yl)pyridin-2-yl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=CN=C(C=C2)C3CN(CCO3)C(=O)CN4C=NC5=CC=CC=C54

DOS

IR

Vibrations