Information card for entry 4312012

Structure parameters

• Formula: C23 H37 Cl N3 P
• Calculated formula: C23 H37 Cl N3 P
• SMILES: P(Cl)(=C1N(C(=C(N1C(C)C)C)C)C(C)C)=Nc1c(cccc1C(C)C)C(C)C
• Title of publication: Ylidene→Iminophosphine Coordination Complexes and Reversible Dissociation of Dichlorophosphetidines
• Authors of publication: Neil Burford; C. Adam Dyker; Andrew D. Phillips; Heather A. Spinney; Andreas Decken; Robert McDonald; Paul J. Ragogna; Arnold L. Rheingold
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 7502 - 7507
• a: 14.031 ± 0.003 Å
• b: 9.522 ± 0.003 Å
• c: 17.977 ± 0.005 Å
• α: 90°
• β: 105.198 ± 0.005°
• γ: 90°
• Cell volume: 2317.8 ± 1.1 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 2 K
• Number of distinct elements: 5
• 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: 0.0717
• Residual factor for significantly intense reflections: 0.0622
• Weighted residual factors for significantly intense reflections: 0.162
• Weighted residual factors for all reflections included in the refinement: 0.1748
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No