Structure 4342295

4342294 << 4342295 >> 4342301
Original COD entry Download CIF Download DOT

Citation: Sun, Hualei; Woodruff, Daniel N.; Cassidy, Simon J.; Allcroft, Genevieve M.; Sedlmaier, Stefan J.; Thompson, Amber L.; Bingham, Paul A.; Forder, Susan D.; Cartenet, Simon; Mary, Nicolas; Ramos, Silvia; Foronda, Francesca R.; Williams, Benjamin H.; Li, Xiaodong; Blundell, Stephen J.; Clarke, Simon J. (2015). Soft Chemical Control of Superconductivity in Lithium Iron Selenide Hydroxides Li1-xFex(OH)Fe1-ySe.. Inorganic chemistry, 54, pp. 1958-1964.

Formula: Fe1.19 H Li0.79 O Se

Chemical name: Lithium iron selenide hydroxide

Cell parameters:

  • a = 3.7677(2) Å
  • b = 3.7677(2) Å
  • c = 9.1552(12) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: Fe2 H2 Li2 O2 (Fe H Li O)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 20, 40, 56, 72, 88, 104, 120, 136
  • 1, 8, 24, 40, 56, 72, 88, 104, 120, 136
  • 5, 20, 40, 56, 72, 88, 104, 120, 136, 152
  • 9, 24, 40, 56, 72, 88, 104, 120, 136, 152
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: Fe2 Se2 (Fe Se)

Multiplicity: 1

Coordination sequences:

  • 4, 16, 24, 32, 40, 48, 56, 64, 72, 80
  • 8, 16, 24, 32, 40, 48, 56, 64, 72, 80
span 1 {1 1 1}