Structure 1566651

1566644 << 1566651 >> 1566652
Original COD entry Download CIF Download DOT

Citation: Falenty, A.; Hansen, T. C.; Kuhs, W. F. (2014). Formation and properties of ice XVI obtained by emptying a type sII clathrate hydrate. Nature, 516, pp. 231-.

Formula: D2 O

Cell parameters:

  • a = 17.1240(3) Å
  • b = 17.1240(3) Å
  • c = 17.1240(3) Å
  • α = 90.00000°
  • β = 90.00000°
  • γ = 90.00000°

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: D544 O136 (D4 O)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 3, 9, 7, 7, 21, 17, 16
  • 2, 4, 5, 4, 8, 11, 10, 20, 26, 22
  • 2, 4, 5, 5, 9, 13, 11, 19, 31, 26
  • 2, 4, 6, 5, 11, 13, 11, 25, 29, 27
  • 2, 4, 6, 6, 12, 15, 15, 27, 39, 30
  • 2, 4, 6, 6, 12, 18, 15, 33, 36, 30
  • 4, 3, 3, 9, 7, 7, 21, 17, 16, 47
  • 4, 4, 4, 12, 9, 9, 27, 21, 21, 63
  • 4, 4, 4, 12, 12, 12, 36, 24, 24, 72
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