Structure 4113465

4113439 << 4113465 >> 4113480
Original COD entry Download CIF Download DOT

Citation: Lionel Beitone; J\'er\^ome Marrot; Thierry Loiseau; G\'erard F\'erey; Marc Henry; Clarisse Huguenard; Axel Gansmuller; Francis Taulelle (2003). MIL-50, an Open-Framework GaPO with a Periodic Pattern of Small Water Ponds and Dry Rubidium Atoms: a Combined XRD, NMR, and Computational Study. Journal of the American Chemical Society, 125, pp. 1912-1922.

Formula: C12 H37 F7 Ga9 N4 O40.5 P9 Rb2

Chemical name: ?

Cell parameters:

  • a = 32.1510(2) Å
  • b = 17.2290(3) Å
  • c = 10.2120(1) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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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: F28 Ga36 O144 P36 (F7 Ga9 O36 P9)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 11, 6, 16, 13, 48, 31, 76
  • 1, 5, 5, 13, 8, 28, 21, 61, 35, 95
  • 2, 7, 5, 15, 10, 34, 23, 63, 34, 95
  • 2, 7, 6, 19, 13, 39, 25, 69, 36, 95
  • 2, 7, 6, 19, 13, 40, 25, 66, 35, 96
  • 2, 7, 6, 19, 13, 40, 27, 74, 38, 101
  • 2, 7, 6, 20, 14, 39, 25, 73, 41, 111
  • 2, 7, 6, 20, 14, 43, 24, 64, 36, 101
  • 2, 7, 7, 22, 14, 43, 27, 74, 41, 109
  • 2, 7, 7, 22, 15, 45, 28, 74, 38, 101
  • 2, 7, 7, 23, 14, 40, 25, 71, 38, 103
  • 2, 7, 7, 23, 14, 41, 25, 72, 41, 105
  • 2, 7, 7, 23, 15, 43, 24, 66, 39, 109
  • 2, 7, 7, 24, 15, 41, 25, 67, 39, 113
  • 2, 8, 4, 10, 8, 28, 21, 61, 35, 95
  • 2, 8, 6, 18, 13, 36, 24, 73, 42, 112
  • 2, 8, 6, 18, 13, 38, 22, 69, 42, 105
  • 2, 8, 7, 20, 14, 42, 26, 76, 42, 108
  • 2, 8, 7, 21, 14, 39, 24, 75, 44, 112
  • 2, 8, 8, 23, 13, 38, 27, 83, 46, 115
  • 2, 9, 6, 15, 11, 40, 26, 67, 37, 107
  • 2, 9, 7, 18, 12, 39, 27, 75, 39, 109
  • 2, 9, 7, 18, 13, 44, 29, 76, 39, 109
  • 4, 3, 11, 6, 16, 13, 48, 31, 76, 39
  • 4, 4, 16, 11, 27, 18, 60, 39, 102, 47
  • 4, 4, 16, 12, 31, 18, 60, 37, 94, 47
  • 4, 4, 16, 12, 32, 20, 61, 34, 87, 48
  • 4, 4, 16, 12, 33, 18, 57, 35, 90, 48
  • 5, 5, 15, 9, 32, 22, 57, 30, 89, 51
  • 5, 5, 15, 10, 33, 22, 58, 32, 94, 50
  • 5, 5, 15, 10, 34, 24, 61, 31, 89, 51
  • 6, 5, 13, 8, 28, 21, 61, 35, 95, 47
  • 6, 6, 16, 11, 34, 23, 67, 39, 107, 49
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