Information card for entry 2206437

Structure parameters

• Chemical name: catena-Poly[[dibromozinc(II)]-μ-1,2-bis(4-pyridyl)ethane]
• Formula: C12 H12 Br2 N2 Zn
• Calculated formula: C12 H12 Br2 N2 Zn
• SMILES: [Zn](Br)(Br)([n]1ccc(cc1)CCc1cc[n](cc1)[Zn](Br)Br)[n]1ccc(cc1)CCc1ccncc1
• Title of publication: <i>catena</i>-Poly[[dibromozinc(II)]-μ-1,2-bis(4-pyridyl)ethane], a one-dimensional coordination polymer
• Authors of publication: Hong, Sung Jin; Lee, Jung Hwan; Lee, Eun Yong; Kim, Cheal; Kim, Youngmee; Kim, Sung-Jin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: m1561 - m1562
• a: 5.5931 ± 0.0006 Å
• b: 8.8605 ± 0.001 Å
• c: 14.0427 ± 0.0015 Å
• α: 90.206 ± 0.002°
• β: 96.662 ± 0.002°
• γ: 96.181 ± 0.002°
• Cell volume: 687.11 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0577
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1443
• Weighted residual factors for all reflections included in the refinement: 0.1461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes