Information card for entry 7040908

Structure parameters

• Formula: C16 H13 Cl2 N3 O3 Pt
• Calculated formula: C16 H11 Cl2 N3 O3 Pt
• SMILES: [Pt]12(Cl)[n]3ccccc3c3cc(cc([n]13)c1cccc[n]21)C(=O)O.[Cl-].O
• Title of publication: Proton-switchable vapochromic behaviour of a platinum(ii)-carboxy-terpyridine complex.
• Authors of publication: Kobayashi, Atsushi; Oizumi, Shiori; Shigeta, Yasuhiro; Yoshida, Masaki; Kato, Masako
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 43
• Pages of publication: 17485 - 17494
• a: 7.463 ± 0.006 Å
• b: 9.743 ± 0.006 Å
• c: 13.044 ± 0.01 Å
• α: 69.55 ± 0.04°
• β: 80.84 ± 0.04°
• γ: 69.53 ± 0.03°
• Cell volume: 831.8 ± 1.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.689 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No