Information card for entry 4121655

Structure parameters

• Formula: C14 H20 N4
• Calculated formula: C14 H18 N4
• Title of publication: A New Highly Fluorescent and Symmetric Pyrrole-BF2 Chromophore: BOPHY.
• Authors of publication: Tamgho, Ingrid-Suzy; Hasheminasab, Abed; Engle, James T.; Nemykin, Victor N.; Ziegler, Christopher J.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 15
• Pages of publication: 5623
• a: 8.9665 ± 0.0005 Å
• b: 9.2535 ± 0.0005 Å
• c: 9.3048 ± 0.0005 Å
• α: 89.782 ± 0.003°
• β: 82.21 ± 0.003°
• γ: 70.804 ± 0.002°
• Cell volume: 721.69 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0469
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No