Information card for entry 7246606

Structure parameters

• Formula: C18 H14 Cl2 N2
• Calculated formula: C18 H14 Cl2 N2
• SMILES: Clc1ccc2[nH]cc(c2c1)C(C)c1[nH]cc2c1cc(Cl)cc2
• Title of publication: Utilization of methanol and ethanol for 3,3′-bis(indolyl)methane synthesis through activation of peroxymonosulfate over a copper catalyst
• Authors of publication: Devi, Arpita; Bharali, Mrinmoy Manash; Biswas, Subir; Bora, Tonmoy J.; Nath, Jayanta K.; Lee, Seonghwan; Park, Young-Bin; Saikia, Lakshi; Baruah, Manash J.; Bania, Kusum K.
• Journal of publication: Green Chemistry
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 9
• Pages of publication: 3443 - 3448
• a: 7.817 ± 0.015 Å
• b: 18.49 ± 0.03 Å
• c: 11.24 ± 0.02 Å
• α: 90°
• β: 96.61 ± 0.04°
• γ: 90°
• Cell volume: 1614 ± 5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: I 1 c 1
• Hall space group symbol: I -2yc
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1238
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No