Information card for entry 8101527

Structure parameters

• Formula: C24 H20 Cl6 Nb P S4
• Calculated formula: C24 H20 Cl6 Nb P S4
• SMILES: [Nb](Cl)(Cl)(Cl)(Cl)(Cl)[Cl-].[P+](Sc1ccccc1)(Sc1ccccc1)(Sc1ccccc1)Sc1ccccc1
• Title of publication: Crystal structure of tetra(thiophenyl)phosphonium hexachloro-niobate(V), [P(SC~6~H~5~)~4~][NbCl~6~]
• Authors of publication: Stumpf, Klaus; Blachnik, Roger; Roth, Georg; Kastner, Guido
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1999
• Journal volume: 214
• Journal issue: 3
• Pages of publication: 399 - 400
• a: 12.594 ± 0.003 Å
• b: 10.182 ± 0.002 Å
• c: 24.385 ± 0.005 Å
• α: 90°
• β: 101.52 ± 0.03°
• γ: 90°
• Cell volume: 3063.9 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.063
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No