生分解性キレート剤が作る鉄(III)錯体の構造予測

DOI Web Site 参考文献7件 オープンアクセス
  • 大友 秀一
    山形大学理学部物質生命化学科，〒990-8560山形市小白川町1-4-12
  • 崎山 博史
    山形大学理学部物質生命化学科，〒990-8560山形市小白川町1-4-12

書誌事項

タイトル別名
  • Molecular Structure Prediction of Iron(III) Complexes with a Biodegradative Chelating Agent

説明

The structures of iron(III) complexes with biodegradative chelating agent, methylglycinediacetic acid [H3(mgda)], were computationally predicted based on the DFT method. The structures of dinuclear iron(III) complexes, [Fe2O(mgda)2(CO3)]4– and [Fe2O(mgda)2(H2O)4]2–, were predicted, and the structures were thought to be similar to those of related dinuclear iron(III) complexes with nitrilotriacetate (nta3–), [Fe2O(nta)2(CO3)]4– and [Fe2O(nta)2(H2O)4]2–, respectively. The mgda complex, [Fe2O(mgda)2(H2O)4]2–, is thought to interact with hydrogen peroxide like the nta complex [Fe2O(nta)2(H2O)4]2–.

収録刊行物

参考文献 (7)*注記

もっと見る

キーワード

詳細情報 詳細情報について

問題の指摘

ページトップへ