Information card for entry 2100374

Structure parameters

• Common name: Kinetin ortophospate acid
• Formula: C10 H12 N5 O5 P
• Calculated formula: C10 H12 N5 O5 P
• Title of publication: Structure of <i>N</i>^6^-furfurylaminopurine (kinetin) dihydrogenphosphate
• Authors of publication: Ślósarek, G.; Kozak, M.; Gierszewski, J.; Pietraszko, A.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: 102 - 108
• a: 8.9243 ± 0.0018 Å
• b: 10.72 ± 0.002 Å
• c: 14.295 ± 0.003 Å
• α: 91.41 ± 0.03°
• β: 100.75 ± 0.03°
• γ: 108.85 ± 0.03°
• Cell volume: 1266.2 ± 0.5 ų
• Cell temperature: 115 ± 2 K
• Ambient diffraction temperature: 115 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1072
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes