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

页码：1349 / 1353

页数：5

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