Structure 1560770

1560769 << 1560770 >> 1560771
Original COD entry Download CIF Download DOT

Citation: Smaha, Rebecca W.; He, Wei; Sheckelton, John P.; Wen, Jiajia; Lee, Young S. (2018). Synthesis-dependent properties of barlowite and Zn-substituted barlowite. Journal of Solid State Chemistry, 268, pp. 123-129.

Formula: Br Cu3 F O6 Zn

Chemical name: Zn-substituted barlowite

Cell parameters:

  • a = 6.675920(31) Å
  • b = 6.675920(31) Å
  • c = 9.322265(14) Å
  • α = 90.0°
  • β = 90.0°
  • γ = 120.0°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

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

Dimensionality: 3

Formula: Br2 Cu6 O12 Zn2 (Br Cu3 O6 Zn)

Multiplicity: 1

Coordination sequences:

  • 3, 22, 61, 144, 243, 390, 531, 748, 936, 1227
  • 6, 41, 96, 209, 294, 497, 600, 911, 1014, 1445
  • 12, 35, 108, 185, 342, 431, 696, 785, 1182, 1241
  • 12, 42, 104, 200, 320, 472, 644, 862, 1086, 1366
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