Information card for entry 2200207

Structure parameters

• Chemical name: 5-chloro-6-nitroso-2-norbornene dimer or 1,2-bis(5-chloronorbornen-6-yl)diazene 1,2-dioxide
• Formula: C14 H16 Cl2 N2 O2
• Calculated formula: C14 H16 Cl2 N2 O2
• SMILES: Cl[C@@H]1[C@H]2C=C[C@@H]([C@@H]1N(=N([C@@H]1[C@H]3C=C[C@@H]([C@@H]1Cl)C3)=O)=O)C2
• Title of publication: 5-Chloro-6-nitroso-2-norbornene dimer as a motif for supramolecular assembly
• Authors of publication: Milovac, Srdjan; Šimunić-Mežnarić, Vesna; Vančik, Hrvoj; Višnjevac, Aleksandar; Kojić-Prodić, Biserka
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 3
• Pages of publication: o218 - o219
• a: 5.9247 ± 0.0007 Å
• b: 13.5925 ± 0.0011 Å
• c: 8.3407 ± 0.0007 Å
• α: 90°
• β: 95.452 ± 0.008°
• γ: 90°
• Cell volume: 668.65 ± 0.11 ų
• Cell temperature: 100 ± 5 K
• Ambient diffraction temperature: 100 ± 5 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for all reflections included in the refinement: 0.0828
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes