Geometry & MOs

Info

ID:	248979
PubChem CID:	103086005
Reduced:	N5C12H17 (1)
Stoich.:	A5B12C17 (1)
Weight, g/mol:	266.092752
ΔH_f, kcal/mol:	81.18
Dipole, Da:	7.85
IP(EA), eV:	-10.04(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-fluoro-4-nitrophenyl)tetrazol-5-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CCCC1=CC=CC=C1N2C(=NN=N2)C(C)N

DOS

IR

Vibrations