2023
DOI: 10.1016/j.molstruc.2022.134894
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Structural study, spectroscopic characterization, DFT calculations and electrical properties of manganese (II) organic-inorganic hybrid material (C8H14N2)2[MnCl4(H2O)2]Cl2

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Cited by 5 publications
(5 citation statements)
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“…The υ(C−C−N), υ(C=C−C) rings stretching mode could be assigned at 1091 and 901 cm −1 . These data are in agreement with other compound treated by similar cations [38,39,47] . A weak band appears at 564 cm −1 , assigned to the δ(Fe−Cl) mode of the anionic group [48,49] …”
Section: Resultssupporting
confidence: 91%
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“…The υ(C−C−N), υ(C=C−C) rings stretching mode could be assigned at 1091 and 901 cm −1 . These data are in agreement with other compound treated by similar cations [38,39,47] . A weak band appears at 564 cm −1 , assigned to the δ(Fe−Cl) mode of the anionic group [48,49] …”
Section: Resultssupporting
confidence: 91%
“…Furthermore, the C−C distances ranging from 1.375 (4) Å to 1.514 (4) Å, while the (C−C−C) angles varying from 119.2 (2)° to 121.7 (2)°. These results are quite comparable to those observed in other compounds containing the same organic groups [38–40] . Table S2 shown in the supporting information, demonstrates the selected bond distances and angles.…”
Section: Resultssupporting
confidence: 87%
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“…Additionally, a more intuitive verification of the above binding energy calculations was performed by using molecular electrostatic potential (MEP) analysis, which offers insights into the chemical reactivity of NNPA with metal ions. 37,38 Fig. 4 shows the surface charge distribution of the NNPA-metal complex, where blue areas represent the positive electrostatic potential region and green areas represent the zero potential region.…”
Section: Metal Ph Isotherm Of D2ehpa-nnpa and Application Discussionmentioning
confidence: 99%