Structure 1531161

1531160 << 1531161 >> 1531162
Original COD entry Download CIF Download DOT

Citation: Chizmeshya, A.V.G.; McKelvy, M.J.; Sharma, R.; Carpenter, R.W.; Bearat, H. (2002). Density functional theory study of the decomposition of Mg (O H)2: a lamellar dehydroxylation model. Materials Chemistry and Physics, 77, pp. 416-425.

Formula: H2 Mg4 O5

Chemical name: Mg4 O3 (O H)2

Cell parameters:

  • a = 3.048 Å
  • b = 3.048 Å
  • c = 12.362 Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: interleaving

List: 2D

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 2

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

Dimensionality: 2

Formula: H Mg O (H Mg O)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 6, 15, 12, 27, 18, 39, 24, 51
  • 3, 9, 9, 21, 15, 33, 21, 45, 27, 57
  • 4, 6, 15, 12, 27, 18, 39, 24, 51, 30
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: H Mg O (H Mg O)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 6, 15, 12, 27, 18, 39, 24, 51
  • 3, 9, 9, 21, 15, 33, 21, 45, 27, 57
  • 4, 6, 15, 12, 27, 18, 39, 24, 51, 30
span 1 {1 1 1}