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- W2058432800 abstract "We have addressed several interesting issues related to trinitromethane: the propellerlike arrangement of its nitro groups, its lower-than-predicted (although still high) acidity, its aci tautomerization, and the absence of expected very short C–H•••O intermolecular bridges in the crystal. A combination of crystallographic and computed data was used in our analysis. The structural features mentioned and the anomalous acidity can be attributed to intra- and/or intermolecular electrostatic interactions. Decomposition via C–NO2 bond scission may occur before aci tautomerization can take place." @default.
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- W2058432800 date "2009-03-10" @default.
- W2058432800 modified "2023-10-17" @default.
- W2058432800 title "Intra- and intermolecular electrostatic interactions and their significance for the structure, acidity, and tautomerization behavior of trinitromethane" @default.
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