Information card for entry 4315019

Structure parameters

• Common name: Adenine-pyrene conjugate
• Formula: C26 H26 Cl2 N7 O8.5
• Calculated formula: C26 H25 Cl2 N7 O8.46
• Title of publication: Silver-Guided Excimer Emission in an Adenine-Pyrene Conjugate: Fluorescence Lifetime and Crystal Studies
• Authors of publication: Mrituanjay D. Pandey; Ashutosh Kumar Mishra; Vadapalli Chandrasekhar; Sandeep Verma
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2020 - 2022
• a: 8.552 ± 0.002 Å
• b: 11.136 ± 0.003 Å
• c: 16.107 ± 0.004 Å
• α: 86.858 ± 0.004°
• β: 85.323 ± 0.004°
• γ: 68.32 ± 0.004°
• Cell volume: 1420.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0946
• Residual factor for significantly intense reflections: 0.073
• Weighted residual factors for significantly intense reflections: 0.2013
• Weighted residual factors for all reflections included in the refinement: 0.2284
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No