Geometry & MOs

Info

ID:	89176
PubChem CID:	49959756
Reduced:	BrIN2O2H12C16 (1)
Stoich.:	ABC2D2E12F16 (1)
Weight, g/mol:	232.030649
ΔH_f, kcal/mol:	32.89
Dipole, Da:	1.5
IP(EA), eV:	-9.03(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylfuran-3-yl)-5-thiophen-2-yl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NN=C(O2)C3=CC(=C(C=C3)OC)Br)I

DOS

IR

Vibrations