Information card for entry 4338044

Structure parameters

• Formula: C123 H136 Fe4 N S8
• Calculated formula: C122.5 H136 Fe4 N S8
• Title of publication: A convenient route to synthetic analogues of the oxidized form of high-potential iron-sulfur proteins.
• Authors of publication: Tanifuji, Kazuki; Yamada, Norihiro; Tajima, Tomoyuki; Sasamori, Takahiro; Tokitoh, Norihiro; Matsuo, Tsukasa; Tamao, Kohei; Ohki, Yasuhiro; Tatsumi, Kazuyuki
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 8
• Pages of publication: 4000 - 4009
• a: 15.7648 ± 0.0015 Å
• b: 16.0212 ± 0.0015 Å
• c: 25.024 ± 0.003 Å
• α: 83.258 ± 0.005°
• β: 83.814 ± 0.005°
• γ: 64.542 ± 0.004°
• Cell volume: 5655.6 ± 1 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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 significantly intense reflections: 0.0553
• Weighted residual factors for all reflections included in the refinement: 0.1743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No