Information card for entry 2206798

Structure parameters

• Chemical name: Dichloro-N-(2,4,6-trimethyl-benzyl)-N-(naphthalen-1-yl-methyl)- imidazolidin-2-ylideneruthenium
• Formula: C24 H26 Cl2 N2 Ru
• Calculated formula: C24 H26 Cl2 N2 Ru
• SMILES: [Ru]123456(Cl)(Cl)[c]7([c]1([cH]2[c]3([cH]4[c]57C)C)C)CN1C=6N(CC1)Cc1c2ccccc2ccc1
• Title of publication: Dichloro[3-(1-naphthylmethyl)-1-(2,4,6-trimethylbenzyl)imidazolidin-2-ylidene]ruthenium
• Authors of publication: Arslan, Hakan; VanDerveer, Don; Özdemir, İsmail; Yaşar, Sedat; Çetinkaya, Bekir
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: m1873 - m1875
• a: 8.6515 ± 0.001 Å
• b: 14.721 ± 0.002 Å
• c: 16.734 ± 0.003 Å
• α: 90°
• β: 97.702 ± 0.004°
• γ: 90°
• Cell volume: 2112 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.038
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes