Structure 4001598

4001597 << 4001598 >> 4001599
Original COD entry Download CIF Download DOT

Citation: Hadermann, Joke; Abakumov, Artem M.; Gillie, Lisa J.; Martin, Christine; Hervieu, Maryvonne (2006). Coupled Cation and Charge Ordering in the CaMn3O6Tunnel Structure. Chemistry of Materials, 18, pp. 5530-.

Formula: Ca Mn3 O6

Chemical name: ?

Cell parameters:

  • a = 10.69557(22) Å
  • b = 11.32418(22) Å
  • c = 8.49009(15) Å
  • α = 90.0°
  • β = 122.3844(11)°
  • γ = 90.0°

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: Mn24 O48 (Mn O2)

Multiplicity: 1

Coordination sequences:

  • 2, 10, 19, 50, 75, 119, 178, 230, 336, 396
  • 2, 14, 23, 39, 71, 122, 186, 235, 294, 393
  • 2, 14, 23, 41, 77, 122, 195, 230, 298, 416
  • 3, 13, 20, 49, 93, 130, 182, 230, 318, 470
  • 3, 14, 20, 60, 91, 134, 183, 244, 343, 445
  • 3, 16, 22, 46, 78, 135, 209, 226, 301, 437
  • 3, 16, 23, 48, 73, 135, 199, 232, 326, 400
  • 3, 16, 23, 48, 77, 145, 197, 230, 327, 417
  • 3, 19, 32, 57, 101, 158, 207, 275, 363, 441
  • 3, 20, 30, 47, 106, 163, 199, 262, 361, 452
  • 3, 20, 32, 53, 103, 160, 211, 270, 363, 457
  • 3, 20, 35, 62, 89, 137, 227, 295, 334, 442
  • 7, 15, 44, 61, 99, 161, 210, 311, 374, 411
  • 8, 14, 33, 63, 105, 153, 211, 274, 372, 487
  • 9, 16, 33, 67, 117, 157, 198, 273, 394, 492
  • 10, 19, 31, 62, 103, 177, 216, 245, 388, 473
  • 10, 20, 34, 62, 112, 164, 222, 278, 373, 465
  • 10, 20, 35, 59, 100, 171, 216, 281, 360, 452
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