Geometry & MOs

Info

ID:	31581
PubChem CID:	855899
Reduced:	ClN4H13C15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	270.067224
ΔH_f, kcal/mol:	103.32
Dipole, Da:	7.25
IP(EA), eV:	-9.62(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-2-methylphenyl)-5-phenyltetrazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN=NN2C3=CC(=C(C=C3)C)Cl

DOS

IR

Vibrations