Synthesis, crystal structure and Hirshfeld surface analysis of sodium bis(malonato)borate monohydrate

被引:1
|
作者
Selvi, Ramalingam [1 ]
Gokila, Govindharajan [1 ]
Thiruvalluvar, Aravazhi Amalan [2 ]
Sundararajan, Raju Sarangapani [3 ]
机构
[1] Bharathidasan Univ, Govt Coll Women Autonomous, Dept Phys, Kumbakonam 612001, Tamil Nadu, India
[2] Kunthavai Naacchiyaar Govt Arts Coll Women Autono, Thanjavur 613007, Tamil Nadu, India
[3] Bharathidasan Univ, Govt Arts Coll Autonomous, Dept Phys, Kumbakonam 612002, Tamil Nadu, India
关键词
synthesis; crystal structure; bis(malonato)borate anion; sodium; Hirshfeld surface analysis.; ION BATTERIES;
D O I
10.1107/S2056989024000537
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the title salt, poly[aqua[mu(4)-bis(malonato)borato]sodium], {[Na(C6H4BO8)]center dot H2O} n or Na+ center dot[B(C3H2O4)(2)] center dot H2O, the sodium cation exhibits fivefold coordination by four carbonyl O atoms of the bis(malonato)borate anions and a water O atom. The tetrahedral B atom at the centre of the anion leads to the formation of a polymeric three-dimensional framework, which is consolidated by C-H center dot center dot center dot O and O-H center dot center dot center dot O hydrogen bonds. A Hirshfeld surface analysis indicates that the most significant contacts in the crystal packing are H center dot center dot center dot O/ O center dot center dot center dot H (49.7%), Na center dot center dot center dot O/O center dot center dot center dot Na (16.1%), O center dot center dot center dot O (12.6%), H center dot center dot center dot H (10.7%) and C center dot center dot center dot O/O center dot center dot center dot C (7.3%).
引用
收藏
页码:180 / +
页数:8
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