Geometry & MOs

Info

ID:	248776
PubChem CID:	103084284
Reduced:	BrClN4C10H10 (1)
Stoich.:	ABC4D10E10 (1)
Weight, g/mol:	285.96209
ΔH_f, kcal/mol:	80.41
Dipole, Da:	5.22
IP(EA), eV:	-10.15(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromophenyl)-5-(1-chloroethyl)tetrazole

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)N2C(=NN=N2)C(C)Cl

DOS

IR

Vibrations