A Neutron Diffraction and Quantum-Chemical Study of [Mn(ND3)6](N3)2

被引：0
|
作者：
Ivlev, Sergei I. [1 ]
Mueller, Thomas G. [1 ]
Karttunen, Antti J. [2 ]
Hoelzel, Markus [3 ]
Kraus, Florian [1 ]
机构：
[1] Philipps Univ Marburg, Fachbereich Chem, D-35032 Marburg, Germany
[2] Aalto Univ, Dept Chem & Mat Sci, Aalto 00076, Finland
[3] Heinz Maier Leibnitz, Forsch Neutronenquelle, D-85747 Garching, Germany
来源：
ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE | 2018年 / 644卷 / 21期
关键词：
Azides; Manganese; Liquid ammonia; Crystal structure; Neutron diffraction; FREQUENCIES;
D O I：
10.1002/zaac.201800217
中图分类号：
O61 [无机化学];
学科分类号：
070301 ; 081704 ;
摘要：
[Mn(ND3)(6)](N-3)(2) was obtained by careful decomposition of [Mn(ND3)(6)](N-3)(2)center dot 4ND(3) at room temperature. It crystallizes in the monoclinic space group I2/m with a = 8.5905(5), b = 6.8506(4), c = 9.7530(6) angstrom, beta = 94.618(6)degrees, V = 572.10(6) angstrom(3), Z = 2, at T = 3 K. Its crystal structure was elucidated using powder neutron diffraction and confirmed by quantum chemical calculations. The Mn-II cation is coordinated octrahedron-like by ND3 ligands. The azide anion is linear with 178.7(10)degrees and shows N-N distances of 1.178(11) and 1.180(12) angstrom.
引用
收藏
页码：1349 / 1353
页数：5
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