Structure 1004150

1004149 << 1004150 >> 1004151
Original COD entry Download CIF Download DOT

Citation: Dupont, L; Hervieu, M; Pelloquin, D; Nowogrocki, G; Touboul, M (1998). Synthesis and crystal structure determination of Tl8 Nb27.2 O72 using TEM and single-crystal x-ray diffraction. Journal of Solid State Chemistry, 135, pp. 282-292.

Formula: Nb27.2 O72 Tl8

Chemical name: Thallium niobium oxide (8/27.2/72)

Cell parameters:

  • a = 7.534(7) Å
  • b = 12.992(12) Å
  • c = 15.555(12) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 1-3D

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 3

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

Dimensionality: 3

Formula: Nb30 O72 (Nb5 O12)

Multiplicity: 1

Coordination sequences:

  • 2, 11, 13, 48, 70, 130, 117, 265, 215, 433
  • 2, 12, 22, 52, 63, 137, 116, 262, 226, 441
  • 2, 12, 23, 50, 63, 140, 120, 265, 210, 442
  • 2, 13, 23, 53, 50, 133, 142, 267, 216, 440
  • 2, 13, 25, 50, 53, 147, 136, 265, 219, 429
  • 2, 13, 28, 57, 64, 155, 150, 290, 237, 471
  • 2, 13, 29, 56, 63, 156, 151, 289, 232, 476
  • 3, 16, 22, 48, 88, 106, 154, 239, 293, 362
  • 3, 18, 19, 48, 86, 121, 150, 236, 290, 386
  • 3, 18, 24, 50, 87, 122, 160, 256, 265, 418
  • 3, 18, 25, 46, 90, 132, 163, 249, 283, 422
  • 3, 18, 33, 47, 77, 146, 170, 239, 301, 382
  • 4, 24, 30, 44, 108, 126, 212, 202, 376, 332
  • 4, 24, 31, 44, 105, 122, 204, 215, 369, 315
  • 7, 12, 37, 52, 104, 98, 223, 199, 378, 296
  • 7, 13, 35, 51, 108, 102, 225, 187, 384, 315
  • 8, 18, 37, 40, 112, 116, 228, 188, 387, 315
  • 8, 18, 38, 41, 108, 112, 226, 196, 385, 292
  • 11, 25, 28, 70, 86, 183, 143, 324, 245, 465
  • 13, 21, 22, 80, 86, 165, 147, 314, 269, 497
  • 13, 22, 22, 78, 78, 154, 160, 301, 243, 510
span 1 {1 1 1}

CIF datablock 1, entity 2 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: Tl36 (Tl)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: Tl36 (Tl)

Multiplicity: 1

span 1 {1 1 1}