Structure 2017524

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Original COD entry Download CIF Download DOT

Citation: Gautier, Romain; Colin, Jean-Fran\,cois; Le Fur, Eric (2010). Two caesium vanadium hydrogenphosphates with tunnelled structures: Cs~2~V~2~O~3~(PO~4~)(HPO~4~) and Cs~2~[(VO)~3~(HPO~4~)~4~(H~2~O)]·H~2~O. Acta Crystallographica Section C, 66, pp. i12-i15.

Formula: Cs2 O21 P4 V3

Chemical name: dicaesium tris[oxidovanadate(IV)] hydrogenphosphate dihydrate

Cell parameters:

  • a = 12.54650(10) Å
  • b = 11.91810(10) Å
  • c = 12.65310(10) Å
  • α = 90.000°
  • β = 96.7859(6)°
  • γ = 90.000°

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: O80 P16 V12 (O20 P4 V3)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 13, 8, 23, 13, 56, 33, 91
  • 1, 3, 3, 13, 9, 26, 14, 60, 36, 104
  • 1, 3, 3, 14, 9, 26, 14, 57, 32, 89
  • 1, 3, 3, 14, 10, 29, 14, 57, 33, 94
  • 1, 4, 4, 12, 7, 31, 21, 61, 25, 94
  • 1, 5, 5, 15, 7, 27, 19, 60, 29, 107
  • 1, 5, 5, 15, 8, 33, 20, 58, 27, 100
  • 2, 7, 5, 17, 11, 41, 24, 75, 37, 126
  • 2, 7, 5, 18, 10, 36, 24, 77, 33, 105
  • 2, 7, 5, 18, 11, 39, 24, 79, 36, 119
  • 2, 7, 5, 18, 12, 43, 23, 71, 34, 118
  • 2, 8, 5, 16, 9, 32, 21, 71, 36, 120
  • 2, 8, 5, 16, 10, 38, 22, 69, 35, 117
  • 2, 8, 5, 17, 10, 34, 21, 71, 36, 122
  • 2, 8, 5, 17, 11, 40, 22, 68, 34, 116
  • 2, 8, 6, 19, 10, 35, 23, 82, 42, 131
  • 2, 8, 6, 20, 11, 36, 22, 78, 39, 123
  • 2, 8, 6, 21, 11, 38, 23, 74, 36, 116
  • 2, 8, 6, 21, 12, 40, 22, 73, 36, 117
  • 2, 10, 6, 16, 9, 38, 23, 65, 30, 121
  • 4, 3, 13, 8, 23, 13, 56, 33, 91, 38
  • 4, 3, 13, 9, 26, 14, 60, 36, 104, 45
  • 4, 3, 14, 9, 26, 14, 57, 32, 89, 42
  • 4, 3, 14, 10, 29, 14, 57, 33, 94, 42
  • 5, 4, 12, 7, 31, 21, 61, 25, 94, 54
  • 6, 5, 15, 7, 27, 19, 60, 29, 107, 60
  • 6, 5, 15, 8, 33, 20, 58, 27, 100, 55
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