Structure 4104229

4104228 << 4104229 >> 4104230
Original COD entry Download CIF Download DOT

Citation: Iliya Todorov; Duck Young Chung; Christos D. Malliakas; Quing'an Li; Thomas Bakas; Alexios Douvalis; Giancarlo Trimarchi; Kenneth Gray; John F. Mitchell; Arthur J. Freeman; Mercouri G. Kanatzidis (2009). CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties. Journal of the American Chemical Society, 131, pp. 5405-5407.

Formula: As3 Ca Fe4

Chemical name: ?

Cell parameters:

  • a = 11.8649(6) Å
  • b = 3.7309(2) Å
  • c = 11.5611(7) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

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: As12 Fe16 (As3 Fe4)

Multiplicity: 1

Coordination sequences:

  • 4, 20, 42, 70, 114, 188, 267, 358, 408, 539
  • 6, 24, 44, 76, 121, 204, 273, 335, 437, 565
  • 7, 28, 44, 81, 139, 207, 274, 350, 452, 585
  • 8, 24, 50, 79, 134, 207, 279, 381, 430, 576
  • 9, 24, 51, 84, 132, 219, 286, 348, 473, 585
  • 11, 24, 45, 85, 141, 207, 276, 351, 456, 591
  • 11, 26, 44, 79, 151, 216, 269, 337, 456, 635
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