Information card for entry 4061130

Structure parameters

• Formula: C30 H19 N3 O10 Ru3
• Calculated formula: C30 H19 N3 O10 Ru3
• SMILES: [Ru]123([Ru]456([Ru]7([NH]1c1nccc[n]41)(C#[O])(C#[O])(C#[O])[C]2(COc1ccccc1)=[C]357C/6=C\COc1ccccc1)(C#[O])C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: η3-Edge-Bridging versus η3-Face-Capping Coordination of a Conjugated Ynenyl Ligand on a Triruthenium Cluster Core
• Authors of publication: Cabeza, Javier A.; del Río, Ignacio; García-Granda, Santiago; Moreno, Marta; Pérez-Carreño, Enrique; Suárez, Marta
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 24
• Pages of publication: 5849 - 5855
• a: 9.209 ± 0.005 Å
• b: 11.477 ± 0.007 Å
• c: 16.107 ± 0.002 Å
• α: 96.44 ± 0.04°
• β: 98.92 ± 0.05°
• γ: 99.33 ± 0.07°
• Cell volume: 1643 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No