Information card for entry 7131286

Structure parameters

• Formula: C120 H107 Mo12 N3 O43 P5
• Calculated formula: C120 H107 Mo12 N3 O43 P5
• Title of publication: Light-induced dissolution and concomitant crystallization of a Keggin-type polyoxometalate mimicking a naturally occurring phenomenon.
• Authors of publication: Tandekar, Kesar; Schmidtmann, Marc; Tripathi, Anjali; Mishra, Neeraj Kumar; Supriya, Sabbani
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 22
• Pages of publication: 3241 - 3244
• a: 14.9244 ± 0.0008 Å
• b: 14.9531 ± 0.0009 Å
• c: 16.6482 ± 0.0009 Å
• α: 84.92 ± 0.003°
• β: 66.901 ± 0.002°
• γ: 67.164 ± 0.002°
• Cell volume: 3140.7 ± 0.3 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 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: 0.074
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1416
• Weighted residual factors for all reflections included in the refinement: 0.1439
• Goodness-of-fit parameter for all reflections included in the refinement: 1.362
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No