Structure 2105431

2105430 << 2105431 >> 2105432
Original COD entry Download CIF Download DOT

Citation: Schmid, H.; Yvon, K.; Kubel, F.; Mao, S.Y. (1991). Tetragonal ferroelastic/antiferroelectric chromium-chlorine boracite, Cr3B7O13Cl, fron x-ray diffraction on a single-domain crystal at 230 K. Acta Crystallographica B (39,1983-), 47, pp. 692-696.

Formula: B7 Cl Cr3 O13

Chemical name: Cr3 (B7 O13) Cl

Cell parameters:

  • a = 12.141 Å
  • b = 12.141 Å
  • c = 12.1606 Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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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: B56 Cl4 Cr24 O104 (B14 Cl Cr6 O26)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 8, 18, 24, 50, 64, 114, 124, 210
  • 3, 6, 16, 24, 51, 57, 107, 121, 200, 188
  • 3, 8, 13, 31, 41, 77, 83, 145, 150, 244
  • 3, 8, 13, 31, 41, 78, 84, 147, 152, 249
  • 3, 9, 13, 29, 39, 75, 86, 147, 147, 246
  • 3, 9, 14, 30, 42, 83, 86, 145, 150, 251
  • 3, 9, 14, 31, 41, 78, 87, 152, 147, 243
  • 3, 9, 14, 31, 42, 82, 87, 148, 149, 248
  • 3, 9, 14, 32, 43, 81, 84, 146, 154, 253
  • 3, 9, 14, 32, 43, 82, 84, 143, 151, 254
  • 3, 9, 15, 33, 41, 79, 89, 154, 148, 244
  • 3, 9, 15, 33, 41, 80, 88, 151, 152, 254
  • 3, 9, 15, 34, 43, 83, 88, 150, 152, 256
  • 3, 9, 15, 34, 43, 86, 90, 162, 163, 262
  • 3, 10, 14, 30, 41, 76, 86, 153, 151, 247
  • 4, 8, 18, 27, 59, 67, 112, 114, 199, 195
  • 4, 8, 19, 26, 55, 64, 117, 125, 205, 183
  • 4, 8, 19, 27, 56, 63, 120, 124, 203, 200
  • 4, 8, 19, 27, 57, 67, 115, 114, 195, 195
  • 4, 8, 20, 27, 52, 60, 118, 128, 210, 196
  • 4, 8, 20, 28, 60, 64, 112, 126, 216, 192
  • 5, 8, 18, 24, 50, 64, 114, 124, 210, 182
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