Information card for entry 7029229

Structure parameters

• Formula: C26 H52 P2 Se2
• Calculated formula: C16 H28 P2 Se2
• SMILES: C(C)(C)(C)[P@H](=[Se])Cc1cccc(c1)C[P@@H](=[Se])C(C)(C)C.C(C)(C)(C)[P@@H](=[Se])Cc1cccc(c1)C[P@H](=[Se])C(C)(C)C
• Title of publication: Secondary diphosphine and diphosphido ligands: synthesis, characterisation and group 1 coordination compounds.
• Authors of publication: Ritch, Jamie S.; Julienne, Delphine; Rybchinski, Shayne R.; Brockman, Kathryne S.; Johnson, Kevin R. D.; Hayes, Paul G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 1
• Pages of publication: 267 - 276
• a: 9.2514 ± 0.0007 Å
• b: 21.7558 ± 0.0018 Å
• c: 12.7311 ± 0.0011 Å
• α: 90°
• β: 90.93 ± 0.006°
• γ: 90°
• Cell volume: 2562.1 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0598
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No