Information card for entry 4304735

Structure parameters

• Formula: C37 H41 Cl2 Mo N O P2 Pd S2
• Calculated formula: C37 H41 Cl2 Mo N O P2 Pd S2
• SMILES: [Pd]12(S[Mo]3456(S1)(N=O)[c]1([c]3([c]4([c]5([c]61C)C)C)C)C)[P](c1ccccc1)(c1ccccc1)CC[P]2(c1ccccc1)c1ccccc1.ClCCl
• Title of publication: Synthesis, Structures, and Properties of Group 9- and Group 10-Group 6 Heterodinuclear Nitrosyl Complexes
• Authors of publication: Kazuya Arashiba; Hidetaka Iizuka; Shoji Matsukawa; Shigeki Kuwata; Yoshiaki Tanabe; Masakazu Iwasaki; Youichi Ishii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 4264 - 4274
• a: 22.457 ± 0.004 Å
• b: 15.578 ± 0.005 Å
• c: 23.52 ± 0.005 Å
• α: 90°
• β: 105.152 ± 0.016°
• γ: 90°
• Cell volume: 7942 ± 3 ų
• Cell temperature: 293.1 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for all reflections included in the refinement: 0.0495
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No