Geometry & MOs

Info

ID:	88925
PubChem CID:	49957818
Reduced:	Cl2N2O3H18C19 (1)
Stoich.:	A2B2C3D18E19 (1)
Weight, g/mol:	372.12407
ΔH_f, kcal/mol:	-51.39
Dipole, Da:	3.11
IP(EA), eV:	-9.08(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chloro-3,5-dimethylphenoxy)methyl]-5-[(2,4-dimethylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)C)OCC2=NN=C(O2)COC3=C(C=C(C=C3)Cl)C

DOS

IR

Vibrations