Geometry & MOs

Info

ID:	332352
PubChem CID:	127250638
Reduced:	FN2O2C11H11 (2)
Stoich.:	AB2C2D11E11 (2)
Weight, g/mol:	368.159689
ΔH_f, kcal/mol:	-212.15
Dipole, Da:	7.49
IP(EA), eV:	-9.32(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[2-[6-(1H-pyrazol-4-yl)pyridin-2-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

C1CNC(=O)N(C1=O)CCC(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=C(C=CC=C4F)F

DOS

IR

Vibrations