Geometry & MOs

Info

ID:	248806
PubChem CID:	103084557
Reduced:	ClSO2N4C7H13 (1)
Stoich.:	ABC2D4E7F13 (1)
Weight, g/mol:	242.129824
ΔH_f, kcal/mol:	-40.69
Dipole, Da:	4.05
IP(EA), eV:	-11.22(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-(3,4-dimethylcyclohexyl)tetrazole

Drug info:

PubChemData

Smile

CC(CS(=O)(=O)C)N1C(=NN=N1)C(C)Cl

DOS

IR

Vibrations