Geometry & MOs

Info

ID:	89000
PubChem CID:	49958629
Reduced:	ClN2O2H11C12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	292.097855
ΔH_f, kcal/mol:	9.12
Dipole, Da:	2.87
IP(EA), eV:	-9.19(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1C2=NN=C(O2)COC3=CC=C(C=C3)Cl

DOS

IR

Vibrations