Geometry & MOs

Info

ID:	70111
PubChem CID:	47207800
Reduced:	SN2O3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	287.039834
ΔH_f, kcal/mol:	-46.71
Dipole, Da:	8.73
IP(EA), eV:	-9.84(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-ethyl-1,3-thiazol-4-yl)methylsulfonylmethyl]-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC(=NO2)CS(=O)(=O)C

DOS

IR

Vibrations