Information card for entry 4310447

Structure parameters

• Common name: compound 7
• Formula: C26 H37 La N16 O9.5 P3
• Calculated formula: C24 H32 La N16 O9 P3
• SMILES: [La]123456([n]7n(P8(=NP9(=NP%10(=N8)N(CCN%10C)C)N(CCN9C)C)n8[n]2c(cc8)c2[n]1cccc2)ccc7c1[n]3cccc1)(ON(=[O]4)=O)(ON(=[O]5)=O)ON(=[O]6)=O
• Title of publication: Generation of Spirotricyclic Site-Differentiated Cyclotriphosphazenes: A Solvent-Free Approach to Multidentate N/O Donor Ligand Systems
• Authors of publication: Michael Harmjanz; Ingmar M. Piglosiewicz; Brian L. Scott; Carol J. Burns
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 642 - 650
• a: 9.6291 ± 0.0013 Å
• b: 11.8931 ± 0.0018 Å
• c: 18.22 ± 0.003 Å
• α: 76.506 ± 0.002°
• β: 81.191 ± 0.003°
• γ: 78.136 ± 0.002°
• Cell volume: 1973.4 ± 0.5 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.1361
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No