Information card for entry 2003481

Structure parameters

• Chemical name: Bis-dioxo ((N,N,N',N'-tetrakis (2-pyridylmethyl-2-ol-1,3-propanediamine) -divanadium (V) Iodide dihydrate ((VO~2~)~2~ (TPHPN))I.2H~2~O
• Formula: C27 H33 I N6 O7 V2
• Calculated formula: C27 H33 I N6 O7 V2
• Title of publication: μ-[<i>N</i>,<i>N</i>-Bis(2-pyridylmethyl-1κ<i>N</i>)-<i>N</i>',<i>N</i>'-bis(2-pyridylmethyl-2κ<i>N</i>)-1,3-diaminopropan-2-olato]-1κ<i>N</i>,2κ<i>N</i>',1:2κ^2^<i>O</i>-bis(dioxovanadium)(1+) Iodide Dihydrate, [(VO~2~)~2~(TPHPN)]I.2H~2~O
• Authors of publication: Neves, A.; Vencato, I.; Hörner, M.; Fenner, H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 809 - 811
• a: 15.369 ± 0.004 Å
• b: 14.399 ± 0.007 Å
• c: 13.772 ± 0.003 Å
• α: 90°
• β: 90.88 ± 0.07°
• γ: 90°
• Cell volume: 3047.4 ± 1.8 ų
• Cell temperature: 293 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0516
• Goodness-of-fit parameter for significantly intense reflections: 2.7
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No