On phosphorus chemical shift anisotropy in metal (IV) phosphates and phosphonates: A 31P NMR experimental study

Bakhmutov, Vladimir I.; Contreras‐Ramirez, Aida; Drake, Hannah; Zhou, Hong‐Cai

doi:10.1002/mrc.5313

On phosphorus chemical shift anisotropy in metal (IV) phosphates and phosphonates: A ³¹P NMR experimental study

Journal Article · Mon Sep 19 00:00:00 EDT 2022 · Magnetic Resonance in Chemistry

DOI:https://doi.org/10.1002/mrc.5313· OSTI ID:2420659

^[1]; Contreras‐Ramirez, Aida ^[2]; Drake, Hannah ^[2]; Zhou, Hong‐Cai ^[2]

Texas A & M Univ., College Station, TX (United States); OSTI
Texas A & M Univ., College Station, TX (United States)

The phosphorus chemical shift anisotropies, ³¹PΔcs, and asymmetry parameters η were measured by the ³¹P{¹H} NMR experiments in static and low-frequency spinning samples of the zirconium phosphates and phosphonates and also in the mixed Zr (IV)/Sn (IV) phosphate/phosphonate material. The data obtained have shown a 111 connectivity in the HPO₄ and PO₃ groups, which does not change at modification and intercalation of the materials. The ³¹PΔcs values of the phosphonate groups (43–49 ppm) significantly surpass the values characterizing the HPO₄ groups (23–37 ppm). The ³¹P Δcs values obtained for the metal (IV) phosphates were discussed in terms of P-O distances. Finally, the ³¹P chemical shift anisotropy parameters can help at elucidation of local structures in phosphate and phosphonate materials.

View Accepted Manuscript (DOE)

Research Organization:: Texas A & M Univ., College Station, TX (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: SC0017864

OSTI ID:: 2420659

Journal Information:: Magnetic Resonance in Chemistry, Journal Name: Magnetic Resonance in Chemistry Journal Issue: 1 Vol. 61; ISSN 0749-1581

Publisher:: WileyCopyright Statement

Country of Publication:: United States

Language:: English

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