Information card for entry 2219772

Structure parameters

• Chemical name: Tris(ethane-1,2-diamine-κ^2^N,N')cobalt(II) <i>cis</i>-aqua-2κO-μ-cyanido- 1:2κ^2^C:N-heptacyanido-1κ^7^C-bis(ethane-1,2-diamine- 2κ^2^N,N')cobalt(II)molybdenum(IV) dihydrate
• Formula: C18 H46 Co2 Mo N18 O3
• Calculated formula: C18 H46 Co2 Mo N18 O3
• SMILES: [Mo](C#N)(C#N)(C#[N][Co]12([NH2]CC[NH2]1)([OH2])[NH2]CC[NH2]2)(C#N)(C#N)(C#N)(C#N)C#N.[Co]123([NH2]CC[NH2]1)([NH2]CC[NH2]2)[NH2]CC[NH2]3.O.O
• Title of publication: Tris(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')cobalt(II) <i>cis</i>-aqua-2κ<i>O</i>-μ-cyanido-1:2κ^2^<i>C</i>:<i>N</i>-heptacyanido-1κ^7^<i>C</i>-bis(ethane-1,2-diamine-2κ^2^<i>N</i>,<i>N</i>')cobalt(II)molybdenum(IV) dihydrate
• Authors of publication: Purcell, W.; Visser, Hendrik G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: m1438 - m1439
• a: 11.5377 ± 0.0003 Å
• b: 14.883 ± 0.0003 Å
• c: 18.7376 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3217.54 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes