Information card for entry 4333506

Structure parameters

• Formula: C26 H38 Cl4 Fe2 Hg2 O8 P2 Se2
• Calculated formula: C26 H38 Cl4 Fe2 Hg2 O8 P2 Se2
• SMILES: CC(C)O[P](OC(C)C)([Fe]1234(C#[O])(C#[O])[cH]5[cH]4[cH]3[cH]2[cH]15)[Se][Hg]1(Cl)[Cl][Hg](Cl)([Cl]1)[Se][P](OC(C)C)(OC(C)C)[Fe]1234(C#[O])(C#[O])[cH]5[cH]4[cH]3[cH]2[cH]15
• Title of publication: Conjugate Base of a Secondary Phosphine Selenide [P(Se)(O^i^Pr)~2~]^-^ as the Bridging Unit for the Construction of Heterometallic Fe(II)‒Hg(II)/Cd(II) Complexes
• Authors of publication: Sarkar, Bijay; Wen, Sung-Yin; Wang, Jyun-Hua; Chiou, Ling-Song; Liao, Ping-Kuei; Santra, Bidyut Kumar; Wang, Ju-Chun; Liu, C. W.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 5129 - 5140
• a: 8.486 ± 0.007 Å
• b: 9.616 ± 0.008 Å
• c: 14.28 ± 0.017 Å
• α: 100.46 ± 0.03°
• β: 92.42 ± 0.03°
• γ: 112.928 ± 0.019°
• Cell volume: 1047.1 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1459
• Weighted residual factors for all reflections included in the refinement: 0.1522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No