Geometry & MOs

Info

ID:	248786
PubChem CID:	103084413
Reduced:	ClN4C8H13 (1)
Stoich.:	AB4C8D13 (1)
Weight, g/mol:	267.052302
ΔH_f, kcal/mol:	62.62
Dipole, Da:	6.09
IP(EA), eV:	-11.02(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-[(4-nitrophenyl)methyl]tetrazole

Drug info:

PubChemData

Smile

CC(C1CC1)N2C(=NN=N2)C(C)Cl

DOS

IR

Vibrations