Information card for entry 7131621

Structure parameters

• Formula: C15 H17 N5 Pt
• Calculated formula: C15 H17 N5 Pt
• SMILES: [Pt]1(=C2N(c3cc(cc[n]13)C)C=CN2C(C)(C)C)(C#N)C#N
• Title of publication: Chromic triboluminescence of self-assembled platinum(II) complexes.
• Authors of publication: Sasaki, Kono; Saito, Daisuke; Yoshida, Masaki; Tanaka, Fuka; Kobayashi, Atsushi; Sada, Kazuki; Kato, Masako
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 44
• Pages of publication: 6745 - 6748
• a: 6.9511 ± 0.0002 Å
• b: 9.3228 ± 0.0003 Å
• c: 11.6052 ± 0.0004 Å
• α: 88.898 ± 0.003°
• β: 84.088 ± 0.003°
• γ: 87.195 ± 0.002°
• Cell volume: 747.09 ± 0.04 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No