Information card for entry 1566536

Structure parameters

• Formula: C84 H108 Ga2 N6 Sb4
• Calculated formula: C84 H108 Ga2 N6 Sb4
• SMILES: C1(=CC(=[N](c2c(C(C)C)cccc2C(C)C)[Ga]2(N1c1c(cccc1C(C)C)C(C)C)N(c1ccccc1)[Sb]1[Sb]2[Sb]2N(c3ccccc3)[Ga]3([N](=C(C=C(C)N3c3c(cccc3C(C)C)C(C)C)C)c3c(cccc3C(C)C)C(C)C)[Sb]12)C)C.c1(ccccc1)C.c1(ccccc1)C
• Title of publication: Synthesis of Distibiranes and Azadistibiranes by Cycloaddition Reactions of Distibenes with Diazomethanes and Azides
• Authors of publication: Weinert, Hanns Micha; Wölper, Christoph; Schulz, Stephan
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 12.0886 ± 0.0004 Å
• b: 12.3645 ± 0.0004 Å
• c: 14.1831 ± 0.0009 Å
• α: 86.028 ± 0.005°
• β: 75.849 ± 0.004°
• γ: 74.786 ± 0.002°
• Cell volume: 1983.54 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0235
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No