Information card for entry 2203111

Structure parameters

• Chemical name: Trans-Bis{2- [(3-cyclohexylaminopropylimino)methyl]phenolato}diazidonickel(II)
• Formula: C32 H48 N10 Ni O2
• Calculated formula: C32 H48 N10 Ni O2
• SMILES: c12c(cccc1)O[Ni]1([N](=C2)CCC[NH2+]C2CCCCC2)([N](=Cc2c(cccc2)O1)CCC[NH2+]C1CCCCC1)(N=N#N)N=N#N
• Title of publication: <i>trans</i>-Diazidobis{2-[(3-cyclohexylaminopropylimino)methyl]phenolato}nickel(II)
• Authors of publication: You, Zhong-Lu; Xiong, Zhong-Duo; Liu, Wei-Sheng; Tan, Min-Yu; Zhu, Hai-Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 1
• Pages of publication: m79 - m81
• a: 7.911 ± 0.004 Å
• b: 9.84 ± 0.005 Å
• c: 21.292 ± 0.01 Å
• α: 101.291 ± 0.007°
• β: 93.077 ± 0.007°
• γ: 92.768 ± 0.007°
• Cell volume: 1620.1 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0726
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0928
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections included in the refinement: 0.855
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes