Information card for entry 7011761

Structure parameters

• Formula: C24 H46 Cl4 P2 Ti
• Calculated formula: C24 H46 Cl4 P2 Ti
• SMILES: [PH](C1CCCCC1)([Ti](Cl)(Cl)([PH](C1CCCCC1)C1CCCCC1)(Cl)Cl)C1CCCCC1
• Title of publication: Single-source CVD routes to titanium phosphide
• Authors of publication: Blackman, Christopher S.; Carmalt, Claire J.; Parkin, Ivan P.; Apostolico, Leonardo; Molloy, Kieran C.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 13
• Pages of publication: 2702
• a: 10.9819 ± 0.0005 Å
• b: 10.1691 ± 0.0003 Å
• c: 13.3319 ± 0.0011 Å
• α: 90°
• β: 103.415 ± 0.005°
• γ: 90°
• Cell volume: 1448.23 ± 0.15 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0543
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for all reflections: 0.1322
• Weighted residual factors for significantly intense reflections: 0.1238
• Goodness-of-fit parameter for all reflections: 1.06
• Goodness-of-fit parameter for significantly intense reflections: 1.087
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No