Geometry & MOs

Info

ID:	248811
PubChem CID:	103084612
Reduced:	ClSN4C9H15 (1)
Stoich.:	ABC4D9E15 (1)
Weight, g/mol:	246.070595
ΔH_f, kcal/mol:	39.98
Dipole, Da:	4.85
IP(EA), eV:	-9.2(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-[(2-methylthiolan-2-yl)methyl]tetrazole

Drug info:

PubChemData

Smile

CC(C1=NN=NN1CC2CCCCS2)Cl

DOS

IR

Vibrations