Structure 1512557

1512556 << 1512557 >> 1512558
Original COD entry Download CIF Download DOT

Citation: Rothkirch, Andr\'e; Gatta, G. Diego; Meyer, Mathias; Merkel, S\'ebastien; Merlini, Marco; Liermann, Hanns-Peter (2013). Single-crystal diffraction at the Extreme Conditions beamline P02.2: procedure for collecting and analyzing high-pressure single-crystal data. Journal of Synchrotron Radiation, 20, pp. 711-720.

Formula: Al2.5 B0.5 O4.5

Chemical name: ?

Cell parameters:

  • a = 5.5494(15) Å
  • b = 14.350(6) Å
  • c = 7.481(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: Al20 B4 O36 (Al5 B O9)

Multiplicity: 1

Coordination sequences:

  • 3, 6, 31, 58, 114, 169, 244, 350, 462, 548
  • 3, 13, 32, 71, 121, 203, 270, 369, 467, 614
  • 3, 14, 27, 69, 118, 181, 262, 355, 445, 582
  • 3, 16, 29, 69, 123, 178, 248, 354, 469, 548
  • 3, 17, 29, 61, 124, 184, 260, 362, 466, 581
  • 3, 21, 45, 82, 139, 217, 294, 414, 507, 625
  • 4, 18, 31, 75, 132, 184, 265, 358, 466, 567
  • 4, 21, 41, 80, 147, 211, 289, 393, 490, 630
  • 5, 10, 35, 59, 104, 193, 277, 326, 468, 588
  • 8, 21, 51, 90, 159, 225, 316, 397, 526, 649
  • 9, 20, 41, 88, 157, 222, 293, 411, 509, 641
  • 10, 23, 49, 99, 156, 215, 312, 412, 511, 637
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