Structure 4003253

4003252 << 4003253 >> 4003254
Original COD entry Download CIF Download DOT

Citation: Santoro, Mario; Scelta, Demetrio; Dziubek, Kamil; Ceppatelli, Matteo; Gorelli, Federico A.; Bini, Roberto; Garbarino, Gaston; Thibaud, Jean-Marc; Di Renzo, Francesco; Cambon, Olivier; Hermet, Patrick; Rouquette, Jerome; van der Lee, Arie; Haines, Julien (2016). Synthesis of 1D Polymer/Zeolite Nanocomposites under High Pressure. Chemistry of Materials, 28, pp. 4065-.

Formula: C1.2 O25.2 Si12

Cell parameters:

  • a = 13.8867(4) Å
  • b = 17.4429(9) Å
  • c = 5.04748(19) Å
  • α = 90.00000°
  • β = 90.00000°
  • γ = 90.00000°

List type: interleaving

List: 1-3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 3

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: O48 Si24 (O2 Si)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 6, 18, 16, 40, 28, 70, 50, 123
  • 2, 6, 6, 18, 16, 40, 28, 71, 45, 105
  • 2, 6, 6, 18, 16, 40, 28, 74, 51, 119
  • 2, 6, 6, 18, 16, 40, 30, 78, 54, 122
  • 2, 6, 6, 18, 16, 42, 29, 71, 50, 116
  • 2, 6, 6, 18, 18, 45, 30, 72, 48, 115
  • 4, 4, 12, 12, 32, 22, 56, 39, 94, 66
  • 4, 4, 12, 12, 32, 22, 56, 41, 104, 68
  • 4, 4, 12, 12, 32, 23, 60, 43, 102, 66
  • 4, 4, 12, 12, 34, 24, 57, 40, 97, 61
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CIF datablock 1, entity 2 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: C4 O4 (C O)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 3, 4, 4, 4, 4, 4, 4, 4
  • 3, 4, 4, 4, 4, 4, 4, 4, 4, 4
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CIF datablock 2, entity 3 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: C4 O4 (C O)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 3, 4, 4, 4, 4, 4, 4, 4
  • 3, 4, 4, 4, 4, 4, 4, 4, 4, 4
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