Information card for entry 4085649

Structure parameters

• Common name: compound 2
• Formula: C23 H25 P
• Calculated formula: C23 H25 P
• SMILES: C1(c2c(c3c1cccc3)cccc2)=P(C)(C)C.Cc1ccccc1
• Title of publication: Fluorenylidene-Functionalized Lithium Phosphonium Di- and Triylides
• Authors of publication: Schröder, Fabian G.; Sundermeyer, Jörg
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 6
• Pages of publication: 1017 - 1020
• a: 14.5317 ± 0.0008 Å
• b: 15.7241 ± 0.0006 Å
• c: 8.1768 ± 0.0005 Å
• α: 90°
• β: 95.232 ± 0.005°
• γ: 90°
• Cell volume: 1860.6 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0873
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0587
• Weighted residual factors for all reflections included in the refinement: 0.0659
• Goodness-of-fit parameter for all reflections included in the refinement: 0.806
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4085588
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No