Information card for entry 7246910

Structure parameters

• Common name: sodium vanadyl phosphate carbonate
• Chemical name: trisodium vanadyl phosphate carbonate
• Formula: C Na3 O8 P V
• Calculated formula: C Na3 O8 P V
• Title of publication: Na3(VO)(PO4)(CO3): a synthetic member of the bradleyite phosphate carbonate family with a new type of crystal structure
• Authors of publication: Yakubovich, Olga; Kiriukhina, Galina; Simonov, Sergey; Volkov, Anatoly; Dimitrova, Olga
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 28
• Pages of publication: 4024 - 4032
• a: 6.3646 ± 0.0004 Å
• b: 6.3135 ± 0.0003 Å
• c: 8.8975 ± 0.0004 Å
• α: 90°
• β: 110.334 ± 0.006°
• γ: 90°
• Cell volume: 335.25 ± 0.03 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0214
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.0464
• Weighted residual factors for all reflections included in the refinement: 0.0468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.266
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No