Geometry & MOs

Info

ID:	248778
PubChem CID:	103084327
Reduced:	ClON4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	250.098524
ΔH_f, kcal/mol:	29.86
Dipole, Da:	7.01
IP(EA), eV:	-9.21(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-(3-propan-2-ylphenyl)tetrazole

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)N2C(=NN=N2)C(C)Cl

DOS

IR

Vibrations