Geometry & MOs

Info

ID:	248821
PubChem CID:	103084681
Reduced:	ClSN4C8H15 (1)
Stoich.:	ABC4D8E15 (1)
Weight, g/mol:	216.114174
ΔH_f, kcal/mol:	38.93
Dipole, Da:	5.29
IP(EA), eV:	-9.06(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-(3,3-dimethylbutyl)tetrazole

Drug info:

PubChemData

Smile

CC(CCN1C(=NN=N1)C(C)Cl)SC

DOS

IR

Vibrations