Information card for entry 4350128

Structure parameters

• Formula: C33 H32 Cl10 Co N9 O7 P3 Zn
• Calculated formula: C33 H30 Cl10 Co N9 O7 P3 Zn
• SMILES: [Co]1234(Cl)[N]5=P(N=P(N=P5(Oc5cccc[n]35)Oc3cccc[n]43)(Oc3ccccn3)Oc3cccc[n]3[Zn](Cl)(Cl)Cl)(Oc3cccc[n]13)Oc1cccc[n]21.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.O
• Title of publication: Di- and trinuclear complexes derived from hexakis(2-pyridyloxy)cyclotriphosphazene. Unusual P-O bond cleavage in the formation of [{(L'CuCl)2(Co(NO3)}Cl] (L' = N3P3(OC5H4N)5(O)).
• Authors of publication: Chandrasekhar, Vadapalli; Pandian, Balasubramanian Murugesa; Azhakar, Ramachandran
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 9
• Pages of publication: 3510 - 3518
• a: 12.4411 ± 0.0007 Å
• b: 14.4689 ± 0.0008 Å
• c: 15.9762 ± 0.0009 Å
• α: 114.744 ± 0.001°
• β: 109.444 ± 0.001°
• γ: 95.729 ± 0.001°
• Cell volume: 2364.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1386
• Weighted residual factors for all reflections included in the refinement: 0.1444
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No