Information card for entry 4334015

Structure parameters

• Formula: C30 H36 N4
• Calculated formula: C30 H36 N4
• SMILES: N1CCN(Cc2c3c(ccc2)cccc3)CCNCCN(CC1)Cc1c2c(cccc2)ccc1
• Title of publication: Argentivorous Molecules Bearing Two Aromatic Side-Arms: Ag±π and CH-π Interactions in the Solid State and in Solution
• Authors of publication: Yoichi Habata; Aya Taniguchi; Mari Ikeda; Takao Hiraoka; Noriko Matsuyama; Sakiko Otsuka; Shunsuke Kuwahara
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2542 - 2549
• a: 11.5947 ± 0.0016 Å
• b: 14.973 ± 0.002 Å
• c: 16.169 ± 0.002 Å
• α: 81.717 ± 0.003°
• β: 78.957 ± 0.002°
• γ: 68.798 ± 0.003°
• Cell volume: 2560 ± 0.6 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.1317
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for significantly intense reflections: 0.1717
• Weighted residual factors for all reflections included in the refinement: 0.2328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No