Structure 4519447

4519424 << 4519447 >> 5000035
Original COD entry Download CIF Download DOT

Citation: Pimentel, Carlos; Pina, Carlos M.; Sainz-D\'iaz, C. Ignacio (2022). New Insights into Dolomite and Dolomite-Analogue Structures from First Principles Calculations. ACS Earth and Space Chemistry, 6, pp. 2360-2367.

Formula: C2 Mg O6 Ra

Chemical name: Radium Magnesium Carbonate

Cell parameters:

  • a = 5.1227 Å
  • b = 5.1227 Å
  • c = 17.2957 Å
  • α = 90.0000°
  • β = 90.0000°
  • γ = 120.0000°

List type: interleaving

List: 2D

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)

Dimensionality: 2

Formula: C2 Mg O6 (C2 Mg O6)

Multiplicity: 1

Coordination sequences:

  • 2, 7, 7, 18, 11, 27, 16, 36, 20, 45
  • 3, 3, 15, 12, 21, 9, 33, 24, 39, 15
  • 6, 6, 12, 6, 24, 18, 30, 12, 42, 30
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CIF datablock 1, entity 2 of 3

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

Dimensionality: 2

Formula: C2 Mg O6 (C2 Mg O6)

Multiplicity: 1

Coordination sequences:

  • 2, 7, 7, 18, 11, 27, 16, 36, 20, 45
  • 3, 3, 15, 12, 21, 9, 33, 24, 39, 15
  • 6, 6, 12, 6, 24, 18, 30, 12, 42, 30
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CIF datablock 2, entity 3 of 3

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

Dimensionality: 2

Formula: C2 Mg O6 (C2 Mg O6)

Multiplicity: 1

Coordination sequences:

  • 2, 7, 7, 18, 11, 27, 16, 36, 20, 45
  • 3, 3, 15, 12, 21, 9, 33, 24, 39, 15
  • 6, 6, 12, 6, 24, 18, 30, 12, 42, 30
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