Information card for entry 4346265

Structure parameters

• Formula: C14 H13 Cl2 N5 O Pd
• Calculated formula: C14 H13 Cl2 N5 O Pd
• SMILES: [Pd]1([N](NC(=O)c2ncccc2)=Cc2[n]1cccc2)(Cl)Cl.N#CC
• Title of publication: Coordination Structure Conversion of Hydrazone-Palladium(II) Complexes in the Solid State and in Solution.
• Authors of publication: Kitamura, Fumi; Sawaguchi, Kana; Mori, Asami; Takagi, Shoji; Suzuki, Takayoshi; Kobayashi, Atsushi; Kato, Masako; Nakajima, Kiyohiko
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 17
• Pages of publication: 8436 - 8448
• a: 7.677 ± 0.003 Å
• b: 11.755 ± 0.004 Å
• c: 18.485 ± 0.008 Å
• α: 90°
• β: 90.255 ± 0.018°
• γ: 90°
• Cell volume: 1668.1 ± 1.1 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• 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: 0.0349
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.1057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No