Information card for entry 1515707

Structure parameters

• Formula: C16 H8 N2
• Calculated formula: C16 H8 N2
• SMILES: N#Cc1c2ccccc2c(c2c1cccc2)C#N
• Title of publication: Preparation, characterization, physical properties, and photoconducting behaviour of anthracene derivative nanowires.
• Authors of publication: Xiao, Jinchong; Yin, Zongyou; Yang, Bo; Liu, Yi; Ji, Li; Guo, Jun; Huang, Ling; Liu, Xuewei; Yan, Qingyu; Zhang, Hua; Zhang, Qichun
• Journal of publication: Nanoscale
• Year of publication: 2011
• Journal volume: 3
• Journal issue: 11
• Pages of publication: 4720 - 4723
• a: 3.7976 ± 0.0001 Å
• b: 8.3908 ± 0.0003 Å
• c: 9.0986 ± 0.0003 Å
• α: 72.193 ± 0.002°
• β: 78.465 ± 0.002°
• γ: 89.756 ± 0.002°
• Cell volume: 269.958 ± 0.015 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0969
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1449
• Weighted residual factors for all reflections included in the refinement: 0.1814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No