Research Article

Synthesis and Supramolecular Structure of a (5-(3-(1H-tetrazol-5-yl)phenyl)-1H-tetrazole) Cobalt Complex

Table 1

Crystal data and structure refinement for 1.

Empirical formula
Formula weight676.39
Temperature100(2) K
Wavelength0.71073 Å
Crystal systemTriclinic
Space groupP-1
Unit cell dimensionsa = 8.3341 (4) Å =84.682 (1)°
b = 8.4696 (5) Å = 73.522 (1)°
c = 11.4730 (6) Å = 65.938 (1)°
Volume708.85 (7) Å3
Z1
Density (calculated)1.584 Mg/m3
Absorption coefficient0.85 m
F(000)345
Crystal size0.36 × 0.31 × 0.25 mm
Index ranges h , ,
Reflections collected 5965
Independent reflections3132 [R (int) = 0.0148]
Data/parameters3132/229
Goodness-of-fit S on 1.071
R indices [I>2sigma(I)]R1 = 0.0337,
wR2 = 0.0854
R indices (all data)R1 = 0.0364,
wR2 = 0.0871
Largest diff. peak
and hole
0.750 and 0.314 e.Å