Structure 4003004

4003002 << 4003004 >> 4003005
Original COD entry Download CIF Download DOT

Citation: Wang, Jian; Mark, Justin; Woo, Katherine E.; Voyles, Jackson; Kovnir, Kirill (2019). Chemical Flexibility of Mg in Pnictide Materials: Structure and Properties Diversity. Chemistry of Materials, 31, pp. 8286-.

Formula: As8 Mg3 Si3

Cell parameters:

  • a = 12.5046(6) Å
  • b = 7.6471(3) Å
  • c = 12.9975(6) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: As32 Mg8 Si12 (As8 Mg2 Si3)

Multiplicity: 1

Coordination sequences:

  • 3, 7, 16, 32, 49, 76, 105, 139, 177, 212
  • 3, 8, 17, 33, 51, 74, 105, 144, 176, 216
  • 3, 9, 15, 29, 48, 77, 97, 130, 171, 223
  • 3, 9, 16, 32, 50, 76, 99, 137, 174, 226
  • 3, 10, 17, 34, 49, 76, 105, 140, 176, 224
  • 4, 8, 18, 31, 52, 77, 109, 130, 181, 230
  • 4, 8, 19, 33, 55, 78, 100, 139, 187, 221
  • 4, 11, 22, 35, 54, 78, 114, 148, 179, 217
  • 5, 12, 22, 36, 50, 82, 114, 145, 181, 217
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