Information card for entry 2010595

Structure parameters

• Chemical name: (1,2-benzisothiazol-3(2H)-one-1,1-dioxide)aquabis(1,10-phenanthroline) manganese(II)1,2-benzisothiazol-3(2H)-one-1,1-dioxide
• Formula: C38 H26 Mn N6 O7 S2
• Calculated formula: C38 H26 Mn N6 O7 S2
• Title of publication: Two saccharinate complexes: [Mn(phen)~2~(sac)(H~2~O)]^+^·sac^{‒^} and [Co(bipy)~2~(sac)(H~2~O)]^+^·sac^{‒^}
• Authors of publication: Deng, Robert M. K.; Bilton, Clair; Dillon, Keith B.; Howard, Judith A. K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 2
• Pages of publication: 142 - 145
• a: 7.943 ± 0.002 Å
• b: 14.448 ± 0.003 Å
• c: 15.336 ± 0.003 Å
• α: 99.01 ± 0.03°
• β: 96.19 ± 0.03°
• γ: 91.54 ± 0.03°
• Cell volume: 1726.4 ± 0.7 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for all reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No