Structure 4123973

4123970 << 4123973 >> 4123974
Original COD entry Download CIF Download DOT

Citation: Waldron, J.E.L.; Green, M.A.; Neumann, D.A. (2001). Charge and spin ordering in monoclinic Nb12 O29. Journal of the American Chemical Society, 123, pp. 5833-5834.

Formula: Nb12 O29

Cell parameters:

  • a = 15.6856 Å
  • b = 3.8307 Å
  • c = 20.7098 Å
  • α = 90°
  • β = 113.056°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

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: Nb24 O58 (Nb12 O29)

Multiplicity: 1

Coordination sequences:

  • 2, 10, 10, 46, 31, 108, 65, 193, 105, 311
  • 2, 10, 10, 46, 34, 112, 68, 200, 106, 320
  • 2, 10, 11, 47, 32, 109, 65, 196, 106, 315
  • 2, 10, 11, 47, 33, 109, 65, 200, 106, 315
  • 2, 10, 12, 47, 32, 108, 64, 200, 108, 313
  • 2, 10, 12, 48, 35, 110, 66, 204, 108, 318
  • 2, 10, 13, 46, 33, 111, 65, 201, 107, 312
  • 2, 10, 13, 47, 33, 111, 65, 196, 107, 313
  • 2, 10, 14, 47, 35, 113, 65, 203, 107, 312
  • 3, 13, 13, 52, 32, 112, 64, 200, 109, 314
  • 3, 13, 13, 52, 32, 112, 65, 202, 109, 317
  • 3, 13, 14, 50, 35, 115, 66, 200, 106, 315
  • 3, 13, 14, 52, 35, 113, 65, 202, 108, 317
  • 3, 13, 15, 53, 36, 115, 66, 205, 110, 318
  • 4, 15, 15, 55, 36, 119, 67, 205, 109, 321
  • 6, 6, 30, 22, 82, 51, 158, 87, 262, 133
  • 6, 7, 31, 22, 79, 48, 157, 86, 261, 133
  • 6, 7, 31, 22, 80, 48, 156, 86, 257, 133
  • 6, 8, 30, 24, 82, 50, 160, 86, 257, 135
  • 6, 8, 31, 24, 82, 50, 156, 86, 257, 135
  • 6, 8, 32, 25, 82, 50, 160, 87, 264, 136
span 1 {1 1 1}