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 weight | 676.39 | | Temperature | 100(2) K | | Wavelength | 0.71073 Å | | Crystal system | Triclinic | | Space group | P-1 | | Unit cell dimensions | a = 8.3341 (4) Å | =84.682 (1)° | | b = 8.4696 (5) Å | = 73.522 (1)° | | c = 11.4730 (6) Å | = 65.938 (1)° | Volume | 708.85 (7) Å3 | | Z | 1 | | Density (calculated) | 1.584 Mg/m3 | | Absorption coefficient | 0.85 m | | F(000) | 345 | | Crystal size | 0.36 × 0.31 × 0.25 mm | | Index ranges | h , , | | Reflections collected |
5965
| | Independent reflections | 3132 [R (int) = 0.0148] | | Data/parameters | 3132/229 | | 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 | |
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