Information card for entry 2015699

Structure parameters

• Chemical name: catena-poly[[di-μ-chloro-κ^2^1:2-μ-1,5-dimethyl-1H-tetrazole- κ^2^N^3^:N^4^]copper(II)]
• Formula: C3 H6 Cl2 Cu N4
• Calculated formula: C3 H6 Cl2 Cu N4
• SMILES: [Cu]12([n]3nn(c(n3)C)C)(Cl)(Cl)[Cl][Cu]([Cl]2)[n]2nn(c([n]12)C)C
• Title of publication: An X-ray powder investigation of <i>catena</i>-poly[copper(II)-di-μ-chloro-κ^4^1:2<i>Cl</i>-μ-1,5-dimethyl-1<i>H</i>-tetrazole-κ^2^<i>N</i>^3^:<i>N</i>^4^]
• Authors of publication: Ivashkevich, Ludmila S.; Lyakhov, Alexander S.; Gaponik, Pavel N.; Degtyarik, Michail M.; Ivashkevich, Oleg A.; Tiutiunnikov, Sergey I.; Efimov, Vadim V.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m607 - m609
• a: 6.8117 ± 0.0004 Å
• b: 7.4177 ± 0.0004 Å
• c: 8.6722 ± 0.0004 Å
• α: 109.167 ± 0.002°
• β: 105.528 ± 0.003°
• γ: 103.121 ± 0.003°
• Cell volume: 374.15 ± 0.04 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Goodness-of-fit parameter for all reflections: 0.76
• Diffraction radiation wavelength: 1.79021 Å
• Diffraction radiation type: CoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No