Geometry & MOs

Info

ID:	174514
PubChem CID:	75775697
Reduced:	FO2N5H28C30 (1)
Stoich.:	AB2C5D28E30 (1)
Weight, g/mol:	437.186318
ΔH_f, kcal/mol:	30.46
Dipole, Da:	3.28
IP(EA), eV:	-8.77(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-fluoro-4-(5-pyridin-3-yl-1,2,4-oxadiazol-3-yl)phenyl]piperidin-3-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

C1CC(CN(C1)C2=C(C=C(C=C2)C3=NOC(=N3)C4=CN=CC=C4)F)C(=O)N5CCC(=CC5)C6=CC=CC=C6

DOS

IR

Vibrations