Information card for entry 7015255

Structure parameters

• Formula: C11 H13 Cl2 N3 O Pt
• Calculated formula: C11 H13 Cl2 N3 O Pt
• SMILES: [Pt]1([n]2[nH]ccc2c2[n]1cccc2)(Cl)Cl.C(=O)(C)C
• Title of publication: A neutral Pt(3) stack unsupported by any bridging ligand.
• Authors of publication: Holland, Lars; Shen, Wei-Zheng; von Grebe, Philipp; Sanz Miguel, Pablo J.; Pichierri, Fabio; Springer, Andreas; Schalley, Christoph A.; Lippert, Bernhard
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 19
• Pages of publication: 5159 - 5161
• a: 8.951 ± 0.0018 Å
• b: 8.997 ± 0.0018 Å
• c: 9.664 ± 0.0019 Å
• α: 102 ± 0.03°
• β: 98.89 ± 0.03°
• γ: 108.26 ± 0.03°
• Cell volume: 702.4 ± 0.3 ų
• Cell temperature: 293 ± 2 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 significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.1497
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No