Geometry & MOs

Info

ID:	27956
PubChem CID:	824327
Reduced:	FNO2H18C20 (1)
Stoich.:	ABC2D18E20 (1)
Weight, g/mol:	341.01975
ΔH_f, kcal/mol:	-53.8
Dipole, Da:	2.51
IP(EA), eV:	-9.42(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-bromophenyl)-3-(diethylaminomethyl)-1,3,4-oxadiazole-2-thione

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)/C=C/2\C(=O)OC(=N2)C3=CC=CC=C3F

DOS

IR

Vibrations