Information card for entry 2240427

Structure parameters

• Chemical name: [1-(Biphenyl-4-yl)-1<i>H</i>-imidazole-κ<i>N</i>^3^]dichloridozinc
• Formula: C30 H24 Cl2 N4 Zn
• Calculated formula: C30 H24 Cl2 N4 Zn
• SMILES: [Zn]([n]1cn(c2ccc(c3ccccc3)cc2)cc1)([n]1ccn(c2ccc(c3ccccc3)cc2)c1)(Cl)Cl
• Title of publication: Crystal structure and luminescent properties of [1-(biphenyl-4-yl)-1<i>H</i>-imidazole-κ<i>N</i>^3^]dichloridozinc
• Authors of publication: Liu, Xiao-Xiao; Wang, Yuan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 3
• Pages of publication: 272 - 274
• a: 9.241 ± 0.0006 Å
• b: 9.2595 ± 0.0005 Å
• c: 16.4106 ± 0.001 Å
• α: 87.77 ± 0.001°
• β: 88.819 ± 0.001°
• γ: 72.823 ± 0.001°
• Cell volume: 1340.5 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0816
• Weighted residual factors for all reflections included in the refinement: 0.0911
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes