Structure 2002474

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Original COD entry Download CIF Download DOT

Citation: Mueller-Buschbaum, Hk; Vogt, R (1990). Neue Verbindungen vom Typ M3 Ln10 O18 (M= Ba + Ca; Ln= Sc + Yb, Ho + Y, La + Y). Ein Beitrag zur Besetzung von Oktaedergeruest und Tunnelstruktur. Zeitschrift fuer Anorganische und Allgemeine Chemie, 589, pp. 89-95.

Formula: Ba Ca2 O18 Sc5 Yb5

Chemical name: Barium dicalcium pentascandium pentaytterbium oxide

Cell parameters:

  • a = 17.13789(450) Å
  • b = 17.13789(450) Å
  • c = 3.2171(45) Å
  • α = 90°
  • β = 90°
  • γ = 120°

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: Ba4 Ca6 O36 Sc18 Yb24 (Ba2 Ca3 O18 Sc9 Yb12)

Multiplicity: 1

Coordination sequences:

  • 5, 65, 221, 350, 772, 1108, 1312, 2176, 2596, 2779
  • 5, 76, 201, 437, 742, 1043, 1587, 2046, 2546, 3349
  • 6, 47, 174, 336, 622, 978, 1303, 1836, 2491, 2880
  • 6, 48, 170, 342, 611, 994, 1288, 1852, 2472, 2895
  • 6, 50, 174, 328, 630, 989, 1313, 1883, 2440, 2857
  • 6, 99, 245, 383, 803, 1151, 1328, 2246, 2741, 2867
  • 8, 63, 175, 418, 675, 923, 1501, 1960, 2311, 3320
  • 8, 64, 168, 411, 671, 945, 1521, 1952, 2299, 3301
  • 8, 64, 170, 409, 681, 933, 1535, 1932, 2307, 3296
  • 16, 87, 193, 479, 793, 995, 1637, 2169, 2353, 3433
  • 16, 87, 195, 472, 795, 994, 1637, 2172, 2358, 3429
  • 16, 87, 202, 487, 786, 968, 1612, 2192, 2375, 3447
  • 23, 112, 269, 505, 814, 1155, 1618, 2178, 2739, 3385
  • 24, 109, 270, 493, 819, 1183, 1607, 2174, 2730, 3389
  • 24, 112, 255, 504, 819, 1182, 1641, 2162, 2706, 3387
  • 29, 96, 260, 542, 731, 1181, 1778, 1976, 2730, 3674
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