Geometry & MOs

Info

ID:	248808
PubChem CID:	103084567
Reduced:	ClSN4C10H13 (1)
Stoich.:	ABC4D10E13 (1)
Weight, g/mol:	351.9388
ΔH_f, kcal/mol:	66.83
Dipole, Da:	6.7
IP(EA), eV:	-9.29(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-(4-fluoro-2-iodophenyl)tetrazole

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)CN2C(=NN=N2)C(C)Cl)C

DOS

IR

Vibrations