Geometry & MOs

Info

ID:	89277
PubChem CID:	49960196
Reduced:	SN2O2H14C19 (1)
Stoich.:	AB2C2D14E19 (1)
Weight, g/mol:	372.04734
ΔH_f, kcal/mol:	63.93
Dipole, Da:	4.55
IP(EA), eV:	-8.7(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2OCC3=NN=C(O3)/C=C/C4=CC=CS4

DOS

IR

Vibrations