Structure 2002464

2002463 << 2002464 >> 2002465
Original COD entry Download CIF Download DOT

Citation: Mueller-Buschbaum, Hk; Lenz, A (1989). Neue Verbindungen vom Typ M3 Ln10 O18: Ba Ca2 Tm10 O18 und Ba Ca2 Tm5 Sc5 O18. Ein Beitrag zur Besetzung der Tunnelstrukturen. Journal of the Less-Common Metals, 156, pp. 173-179.

Formula: Ba Ca2 O18 Sc5 Tm5

Chemical name: Barium dicalcium pentathulium pentascandium oxide

Cell parameters:

  • a = 17.17169(220) Å
  • b = 17.17169(220) Å
  • c = 3.2292(2) Å
  • α = 90°
  • β = 90°
  • γ = 120°

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 2

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

Dimensionality: 3

Formula: Ca6 O36 Sc18 Tm24 (Ca O6 Sc3 Tm4)

Multiplicity: 1

Coordination sequences:

  • 1, 20, 86, 202, 380, 589, 880, 1241, 1631, 2084
  • 6, 39, 114, 223, 468, 715, 939, 1357, 1828, 2243
  • 6, 44, 142, 276, 518, 820, 1065, 1477, 1999, 2399
  • 6, 44, 147, 282, 454, 708, 1068, 1457, 1808, 2259
  • 8, 49, 135, 289, 489, 722, 1097, 1487, 1850, 2356
  • 8, 50, 142, 298, 551, 771, 1035, 1555, 1926, 2396
  • 8, 52, 149, 305, 490, 782, 1131, 1437, 1935, 2418
  • 14, 52, 143, 298, 552, 796, 1033, 1569, 1942, 2397
  • 14, 55, 162, 332, 518, 822, 1187, 1498, 2004, 2493
  • 14, 55, 162, 351, 553, 828, 1205, 1550, 1987, 2532
  • 20, 77, 172, 366, 628, 794, 1195, 1653, 1991, 2624
  • 20, 77, 175, 355, 594, 869, 1203, 1614, 2048, 2573
  • 21, 86, 202, 380, 589, 880, 1241, 1631, 2084, 2588
  • 22, 94, 217, 377, 588, 914, 1273, 1644, 2081, 2542
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: Ba2 (Ba)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}