Structure 9017423

9017422 << 9017423 >> 9017425
Original COD entry Download CIF Download DOT

Citation: Rozenberg, K. A.; Rastsvetaeva, R. K.; Chukanov, N. V. (2009). Crystal structures of oxalate-bearing cancrinite with an unusual arrangement of CO3 groups and sulfate-rich davyne Note: Bruker SMART CCD diffractometer. Crystallography Reports, 54, pp. 793-799.

Formula: C0.5 H1.5 Al3 Ca0.04 K0.15 Na3.58 O14.25 Si3

Cell parameters:

  • a = 12.688 Å
  • b = 12.688 Å
  • c = 5.189 Å
  • α = 90°
  • β = 90°
  • γ = 120°

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 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C4 K6 Na18 O12 (C2 K3 Na9 O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 3

Formula: Al6 O24 Si6 (Al O4 Si)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 6, 16, 14, 39, 26, 64, 42, 104
  • 2, 6, 6, 17, 14, 38, 26, 64, 42, 104
  • 2, 6, 6, 18, 14, 35, 26, 70, 42, 96
  • 4, 4, 12, 10, 28, 20, 52, 34, 84, 54
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