Information card for entry 7005487

Structure parameters

• Common name: catena-((bis(mu-trans-bis(3,5-dimethyl-1H- pyrazolyl)selenide)) zinc(ii)) dinitrate
• Chemical name: catena-{(bis[mu-trans-bis(3,5-dimethyl-1H-pyrazolyl)selenide]) zinc(II)} dinitrate
• Formula: C20 H28 N10 O6 Se2 Zn
• Calculated formula: C20 H28 N10 O6 Se2 Zn
• Title of publication: Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.
• Authors of publication: Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 29
• Pages of publication: 3183 - 3194
• a: 13.2301 ± 0.0004 Å
• b: 13.2301 ± 0.0004 Å
• c: 15.8544 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2775.08 ± 0.14 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 120
• Hermann-Mauguin space group symbol: I -4 c 2
• Hall space group symbol: I -4 -2c
• Residual factor for all reflections: 0.0283
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections included in the refinement: 0.0607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No