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Geometric and energetic data from ab initio calculations of haloethene, haloimine, halomethylenephosphine, haloiminophosphine, halodiazene, halodiphosphene and halocyclopropane

This article presents theoretical data on geometric and energetic features of halogenated compounds of ethene (C[bond, double bond]C), imine (C[bond, double bond]N), methylenephosphine (C[bond, double bond]P), iminophosphine (N[bond, double bond]P), diazene (N[bond, double bond]N), diphosphene (P[bo...

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Bibliografiske detaljer
Udgivet i:Data Brief
Main Authors: Chinsukserm, Kridtin, Lorpaiboon, Wanutcha, Teeraniramitr, Peerayar, Limpanuparb, Taweetham
Format: Artigo
Sprog:Inglês
Udgivet: Elsevier 2019
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6861602/
https://ncbi.nlm.nih.gov/pubmed/31763395
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.dib.2019.104738
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