Information card for entry 7002900

Structure parameters

• Formula: C99 H96 F6 N12 Nd2 O19 S2
• Calculated formula: C99 H96 F6 N12 Nd2 O19 S2
• Title of publication: Syntheses, structures, and photoluminescence of 1-D lanthanide coordination polymers
• Authors of publication: Yang, Xiaoping; Jones, Richard A.; Rivers, Joseph H.; Wong, Wai-Kwok
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 47
• Pages of publication: 10505 - 10510
• a: 9.5105 ± 0.0019 Å
• b: 14.286 ± 0.003 Å
• c: 17.87 ± 0.004 Å
• α: 82.99 ± 0.03°
• β: 89.68 ± 0.04°
• γ: 83.67 ± 0.03°
• Cell volume: 2395 ± 0.9 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1185
• Residual factor for significantly intense reflections: 0.0737
• Weighted residual factors for significantly intense reflections: 0.1771
• Weighted residual factors for all reflections included in the refinement: 0.2076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No