Structure 4031608

4031599 << 4031608 >> 4031610
Original COD entry Download CIF Download DOT

Citation: Vanderah, T.A.; Ramirez, A.P.; Siegrist, T.; Roth, R.S.; Geyer, R.G. (2004). Crystal Structure and Properties of Ba11 Fe Ti27 O66.5. European Journal of Inorganic Chemistry, 2004, pp. 2434-2441.

Formula: Ba11 O66.5 Ti28

Chemical name: Ba11 Ti28 O66.5

Cell parameters:

  • a = 23.321 Å
  • b = 11.384 Å
  • c = 9.847 Å
  • α = 90°
  • β = 90.09°
  • 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: O132 Ti56 (O33 Ti14)

Multiplicity: 1

Coordination sequences:

  • 2, 10, 10, 60, 76, 130, 148, 228, 218, 412
  • 2, 11, 14, 64, 97, 143, 141, 267, 287, 485
  • 2, 12, 16, 35, 60, 119, 161, 238, 254, 372
  • 2, 12, 16, 38, 52, 95, 165, 236, 266, 369
  • 2, 12, 18, 58, 82, 139, 160, 268, 270, 435
  • 2, 12, 18, 59, 80, 141, 168, 254, 266, 428
  • 2, 13, 22, 52, 70, 138, 150, 269, 294, 452
  • 2, 14, 25, 51, 58, 137, 193, 292, 307, 413
  • 2, 15, 28, 55, 80, 135, 170, 272, 306, 450
  • 2, 15, 28, 57, 89, 139, 173, 274, 320, 451
  • 2, 18, 30, 36, 84, 100, 214, 312, 276, 384
  • 3, 16, 18, 50, 61, 133, 186, 235, 285, 408
  • 3, 16, 19, 41, 71, 121, 196, 219, 297, 391
  • 3, 16, 20, 45, 64, 110, 197, 226, 311, 386
  • 3, 17, 27, 62, 94, 113, 177, 234, 349, 443
  • 3, 17, 27, 63, 91, 119, 171, 242, 350, 438
  • 3, 21, 32, 63, 100, 136, 186, 298, 306, 477
  • 3, 23, 37, 53, 101, 130, 191, 279, 354, 481
  • 3, 25, 36, 37, 109, 113, 221, 239, 374, 442
  • 4, 17, 22, 77, 75, 117, 166, 256, 348, 445
  • 4, 19, 20, 49, 80, 113, 230, 220, 339, 410
  • 6, 6, 39, 59, 111, 132, 206, 216, 383, 353
  • 7, 10, 38, 60, 104, 100, 206, 234, 380, 427
  • 8, 14, 33, 47, 102, 145, 214, 241, 346, 412
  • 8, 14, 34, 41, 95, 132, 222, 250, 358, 391
  • 9, 18, 44, 74, 101, 127, 217, 269, 406, 450
  • 10, 17, 27, 58, 68, 153, 220, 254, 342, 390
  • 10, 18, 26, 59, 100, 149, 229, 238, 348, 438
  • 10, 22, 44, 80, 102, 146, 210, 290, 404, 492
  • 11, 21, 31, 61, 87, 172, 205, 267, 361, 459
  • 11, 22, 43, 84, 90, 165, 181, 329, 379, 504
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