Information card for entry 7233354

Structure parameters

• Common name: Heptacyclic Benzo[a]phenazinone
• Formula: C35 H27 Br N2 O4
• Calculated formula: C36 H27 Br N2 O4
• Title of publication: Two step, one-pot sequential synthesis of functionalized hybrid polyheterocyclic scaffolds via a solid state melt reaction (SSMR)
• Authors of publication: Bakthadoss, Manickam; Srinivasan, Jayakumar; Hussain, Mir Ashiq; Sharada, Duddu S.
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 42
• Pages of publication: 24314
• a: 10.8736 ± 0.0011 Å
• b: 11.2191 ± 0.0011 Å
• c: 12.8583 ± 0.0013 Å
• α: 70.525 ± 0.009°
• β: 84.72 ± 0.008°
• γ: 84.754 ± 0.008°
• Cell volume: 1469.5 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 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: 0.1292
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1384
• Weighted residual factors for all reflections included in the refinement: 0.1773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No