Information card for entry 7005000

Structure parameters

• Formula: C98 H106 Co7 N38 O S2
• Calculated formula: C98 H106 Co7 N38 O S2
• Title of publication: The nano-scale molecule with the longest delocalized metal-metal bonds: linear heptacobalt(II) metal string complexes [Co7(micro7-L)4X2].
• Authors of publication: Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 8
• Pages of publication: 830 - 839
• a: 30.641 ± 0.001 Å
• b: 16.2874 ± 0.0006 Å
• c: 22.2876 ± 0.0007 Å
• α: 90°
• β: 109.727 ± 0.002°
• γ: 90°
• Cell volume: 10470.1 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2063
• Residual factor for significantly intense reflections: 0.0881
• Weighted residual factors for significantly intense reflections: 0.2592
• Weighted residual factors for all reflections included in the refinement: 0.3302
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No