Structure 2310708

2310706 << 2310708 >> 2310709
Original COD entry Download CIF Download DOT

Citation: Albe, K.; Weirich, T. E. (2003). Structure and stability of \a- and \b-Ti~2~Se. Electron diffraction versus density-functional theory calculations. Acta Crystallographica Section A, 59, pp. 18-21.

Formula: Se Ti2

Chemical name: Ti2 Se

Cell parameters:

  • a = 11.752 Å
  • b = 14.534 Å
  • c = 3.453 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: Se12 Ti24 (Se Ti2)

Multiplicity: 1

Coordination sequences:

  • 7, 33, 79, 146, 231, 328, 468, 607, 762, 961
  • 8, 33, 81, 145, 237, 332, 464, 602, 762, 957
  • 8, 34, 80, 146, 229, 338, 456, 606, 771, 948
  • 8, 36, 80, 144, 222, 334, 464, 600, 754, 940
  • 9, 35, 78, 148, 238, 331, 457, 613, 771, 959
  • 10, 37, 81, 146, 236, 339, 459, 614, 768, 952
  • 11, 35, 80, 152, 232, 344, 456, 600, 780, 960
  • 11, 35, 83, 145, 229, 340, 465, 598, 766, 954
  • 12, 40, 85, 154, 235, 344, 476, 616, 787, 961
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