Information card for entry 8101662

Structure parameters

• Formula: C31 H32 I2 Ni O2 P2
• Calculated formula: C31 H32 I2 Ni O2 P2
• SMILES: I[Ni]1(I)[P](c2ccccc2)(c2ccccc2)C[C@H]2[C@H](C[P]1(c1ccccc1)c1ccccc1)OC(C)(C)O2
• Title of publication: Crystal structure of diiodo[(-)-2,2-dimethyl-4,5-bis(diphenylphoshinomethyl)- 1,3-dioxolane-<i>P</i>,<i>P</i>'] nickel, C~31~H~32~I~2~NiO~2~P~2~
• Authors of publication: Frenzen, Gerlinde; Rabe, Susanne; Frauenrath, Herbert; Reim, Stefan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1998
• Journal volume: 213
• Journal issue: 4
• Pages of publication: 777 - 778
• a: 9.8823 ± 0.0008 Å
• b: 17.411 ± 0.002 Å
• c: 18.608 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3201.8 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1137
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No