Geometry & MOs

Info

ID:	89134
PubChem CID:	49959558
Reduced:	SBr2N2O2H10C15 (1)
Stoich.:	AB2C2D2E10F15 (1)
Weight, g/mol:	501.83502
ΔH_f, kcal/mol:	55.67
Dipole, Da:	3.46
IP(EA), eV:	-9.39(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CSC(=C1)/C=C/C2=NN=C(O2)COC3=C(C=C(C=C3)Br)Br

DOS

IR

Vibrations