Geometry & MOs

Info

ID:	89006
PubChem CID:	49958688
Reduced:	OSN2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	287.046154
ΔH_f, kcal/mol:	24.68
Dipole, Da:	4.16
IP(EA), eV:	-9.49(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenoxy)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CCCC1=NN=C(O1)C2=CC=CS2

DOS

IR

Vibrations