Information card for entry 7006480

Structure parameters

• Formula: C43 H36 Ag2 Fe2 N10 O6
• Calculated formula: C43 H33 Ag2 Fe2 N10 O6
• SMILES: [Ag]([n]1ccnc([c]23[cH]4[cH]5[cH]6[cH]2[Fe]27895634[c]3([cH]7[cH]8[cH]9[cH]23)c2c[n]([Ag]3)ccn2)c1)([n]1ccnc([c]24[cH]5[cH]6[cH]7[cH]2[Fe]289%104567[c]4([cH]2[cH]8[cH]9[cH]%104)c2c[n]3ccn2)c1)ON(=O)=O.c1(ccccc1)C.N(=O)(=O)[O-]
• Title of publication: Metal complexes from 1,1'-di(pyrazinyl)ferrocene: coordination polymers and bridged diferrocenes.
• Authors of publication: Mochida, Tomoyuki; Okazawa, Kazuya; Horikoshi, Ryo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 5
• Pages of publication: 693 - 704
• a: 20.5823 ± 0.0011 Å
• b: 13.2444 ± 0.0007 Å
• c: 14.9704 ± 0.0008 Å
• α: 90°
• β: 97.612 ± 0.001°
• γ: 90°
• Cell volume: 4045 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No