Information card for entry 7016693

Structure parameters

• Formula: C22 H20 Cr2 N2 O10
• Calculated formula: C22 H20 Cr2 N2 O10
• SMILES: [Cr](=C(N1CCCCC1)C(=[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])N1CCCCC1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: The use of 1,2-dipiperidinoacetylene for the preparation of monometallic diaminoacetylene and homo- or heterobimetallic diaminodicarbene ruthenium(ii) complexes.
• Authors of publication: Petrov, Alex R.; Bannenberg, Thomas; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 40
• Pages of publication: 10503 - 10512
• a: 9.4757 ± 0.0008 Å
• b: 9.6051 ± 0.0006 Å
• c: 15.9506 ± 0.0014 Å
• α: 103.107 ± 0.006°
• β: 94.293 ± 0.006°
• γ: 118.08 ± 0.008°
• Cell volume: 1219.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0378
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 0.924
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No