Information card for entry 2227915

Structure parameters

• Chemical name: Acetato(<i>N</i>-[(<i>E</i>)-1-(6-methyl-2-pyridyl)methylidene]-2-{2- [(<i>E</i>)-1-(6-methyl-2-pyridyl)methylideneamino]phenethyl}aniline)nickel(II) perchlorate
• Formula: C30 H29 Cl N4 Ni O6
• Calculated formula: C30 H29 Cl N4 Ni O6
• SMILES: [Ni]1234([n]6c(C)cccc6C=[N]1c1ccccc1CCc1ccccc1[N]2=Cc1cccc(C)[n]31)[O]=C(O4)C.Cl(=O)(=O)(=O)[O-]
• Title of publication: Acetato(<i>N</i>-[(<i>E</i>)-1-(6-methyl-2-pyridyl)methylidene]-2-{2-[(<i>E</i>)-1-(6-methyl-2-pyridyl)methylideneamino]phenethyl}aniline)nickel(II) perchlorate
• Authors of publication: Sarkar, Shuranjan; Lee, Hajin; Lee, Hong-In
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: m1184
• a: 8.5759 ± 0.0008 Å
• b: 11.4975 ± 0.001 Å
• c: 14.8322 ± 0.0013 Å
• α: 79.392 ± 0.002°
• β: 78.102 ± 0.002°
• γ: 81.327 ± 0.002°
• Cell volume: 1396.9 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.15
• Residual factor for significantly intense reflections: 0.0682
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.1487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes