Geometry & MOs

Info

ID:	248770
PubChem CID:	103084233
Reduced:	FCl2N4H7C9 (1)
Stoich.:	AB2C4D7E9 (1)
Weight, g/mol:	264.114174
ΔH_f, kcal/mol:	35.92
Dipole, Da:	5.36
IP(EA), eV:	-10.32(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-tert-butylphenyl)-5-(1-chloroethyl)tetrazole

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C2=C(C=C(C=C2)F)Cl)Cl

DOS

IR

Vibrations