Information card for entry 1575447

Structure parameters

• Formula: C29 H30 N2 O2
• Calculated formula: C29 H30 N2 O2
• Title of publication: Efficient C(sp3)–H alkylation of fluorene and bisindolylmethane synthesis catalysed by a PNN-Ni complex using alcohols
• Authors of publication: Mohite, Manali A.; Balakrishna, Maravanji S.
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 19
• Pages of publication: 5713 - 5723
• a: 11.9352 ± 0.0012 Å
• b: 9.6405 ± 0.0011 Å
• c: 22.561 ± 0.003 Å
• α: 90°
• β: 102.676 ± 0.003°
• γ: 90°
• Cell volume: 2532.6 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0953
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1614
• Weighted residual factors for all reflections included in the refinement: 0.185
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No