Information card for entry 2204466

Structure parameters

• Chemical name: Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]-2- naphtholato}tetrazinc(II)
• Formula: C60 H64 N8 O8 Zn4
• Calculated formula: C60 H64 N8 O8 Zn4
• SMILES: c12c(ccc3ccccc13)O[Zn]134[N](=C2)CC[NH]1CC[O]3[Zn]123[N](=Cc5c(ccc6ccccc56)O2)CC[NH]1CC[O]3[Zn]123[N](=Cc5c(ccc6ccccc56)O2)CC[NH]1CC[O]3[Zn]123[N](=Cc5c(ccc6ccccc56)O2)CC[NH]1CC[O]43
• Title of publication: Tetrakis{μ-1-[2-(2-oxidoethylamino)ethyliminomethyl]-2-naphtholato}tetrazinc(II)
• Authors of publication: You, Zhong-Lu; Ma, Ji-Long; Zhu, Hai-Liang; Liu, Wei-Sheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 11
• Pages of publication: m1599 - m1601
• a: 18.23 ± 0.003 Å
• b: 18.23 ± 0.003 Å
• c: 8.531 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2835.1 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1039
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes