Structure 1001486

1001485 << 1001486 >> 1001487
Original COD entry Download CIF Download DOT

Citation: Michel, C; Suard, E; Caignaert, V; Martin, C; Maignan, A; Hervieu, M; Raveau, B (1991). Neutron diffraction structure determination of the "1212"-series TlBa~2~Ca~1-x~Nd~x~Cu~2~O~7-d~. Physica C (Amsterdam) (152,1988-), 178, pp. 29-36.

Formula: Ba2 Cu2 Nd O6.96 Tl0.96

Chemical name: Thallium(III) barium neodymium copper oxide (0.96/2/1/2/6.96)

Cell parameters:

  • a = 3.91021(5) Å
  • b = 3.91021(5) Å
  • c = 12.4916(2) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: Cu2 Nd O10 Tl4 (Cu2 Nd O10 Tl4)

Multiplicity: 1

Coordination sequences:

  • 4, 33, 78, 168, 296, 429, 620, 829, 1052, 1380
  • 5, 21, 74, 129, 253, 410, 605, 865, 1126, 1377
  • 7, 19, 32, 70, 166, 260, 436, 684, 844, 1138
  • 9, 49, 106, 205, 365, 518, 705, 957, 1198, 1497
  • 10, 20, 48, 128, 218, 370, 592, 758, 1032, 1373
  • 20, 56, 124, 248, 364, 522, 740, 920, 1212, 1576
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