Information card for entry 2012953

Structure parameters

• Chemical name: Bis(trichlorophosphino)iminium hexachloroniobate
• Formula: Cl12 N Nb P2
• Calculated formula: Cl12 N Nb P2
• SMILES: N(=P(Cl)(Cl)Cl)[P+](Cl)(Cl)Cl.[Cl-][Nb](Cl)(Cl)(Cl)(Cl)Cl
• Title of publication: Bis(trichlorophosphine)iminium salts, [Cl~3~P=N=PCl~3~]^+^, with transition metal halide counter-ions
• Authors of publication: Rivard, Eric; McWilliams, Andrew R.; Lough, Alan J.; Manners, Ian
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: i114 - i118
• a: 13.4095 ± 0.0007 Å
• b: 8.5268 ± 0.0006 Å
• c: 15.0432 ± 0.0009 Å
• α: 90°
• β: 103.928 ± 0.004°
• γ: 90°
• Cell volume: 1669.47 ± 0.18 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.038
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes