Structure 4002513

4002512 << 4002513 >> 4002514

Citation: Johnsson, M.; Tornroos, K.W.; Lemmens, P.; Millet, P. (2003). Crystal structure and magnetic properties of a new two-dimensional S = 1 quantum system Ni5 (Te O3)3 X2 (X = Cl, Br). Chemistry of Materials (1,1989-), 15, pp. 68-73.

Formula: Br2 Ni5 O12 Te4

Chemical name: Ni5 (Te O3)4 Br2

Cell parameters:

a = 20.2554 Å
b = 5.2498 Å
c = 16.3005 Å

α = 90°
β = 124.937°
γ = 90°

List type: interleaving

List: 2D

Molecules

CIF datablock 0, entity 1 of 2

Basis: (0;1;0 0;0;1)

Dimensionality: 2

Formula: Br4 Ni10 O24 Te8 (Br2 Ni5 O12 Te4)

Multiplicity: 1

Coordination sequences:

1, 7, 16, 34, 42, 61, 67, 79, 94, 99
2, 12, 18, 32, 51, 58, 69, 86, 93, 112
3, 14, 25, 48, 50, 60, 81, 91, 101, 110
3, 17, 27, 47, 52, 66, 78, 91, 106, 105
4, 10, 26, 35, 49, 63, 75, 84, 103, 110
4, 14, 40, 42, 56, 67, 80, 96, 103, 108
4, 15, 21, 40, 51, 62, 76, 86, 91, 116
4, 18, 27, 42, 57, 67, 74, 94, 97, 118
4, 20, 29, 38, 61, 70, 70, 97, 103, 107
8, 16, 34, 42, 61, 67, 79, 94, 99, 119
10, 17, 31, 49, 52, 64, 87, 89, 104, 117
10, 22, 30, 42, 58, 70, 80, 84, 104, 124

span 1 {1 1 1}

highlight edges

CIF datablock 1, entity 2 of 2