Geometry & MOs

Info

ID:	88943
PubChem CID:	49958021
Reduced:	N3O4H15C17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	348.043233
ΔH_f, kcal/mol:	15.19
Dipole, Da:	3.83
IP(EA), eV:	-8.67(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-])C

DOS

IR

Vibrations