Structure 7235420

7235419 << 7235420 >> 7235421
Original COD entry Download CIF Download DOT

Citation: Williams, Edward R.; Marshall, Kayleigh; Weller, Mark T. (2015). Copper(ii) chlorofluorophosphate: a new layered square-net for intercalating amines. CrystEngComm, 17, pp. 160-.

Formula: C4 H11 Cl Cu4 F4 N2 O12 P4

Cell parameters:

  • a = 13.9096(6) Å
  • b = 13.6136(5) Å
  • c = 19.7230(10) 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: Cl4 Cu16 F16 O52 P16 (Cl Cu4 F4 O13 P4)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 4, 17, 21, 25, 18, 32, 50, 52
  • 1, 4, 12, 8, 20, 8, 28, 40, 48, 32
  • 2, 9, 12, 21, 22, 23, 33, 46, 50, 44
  • 3, 12, 13, 21, 19, 28, 36, 46, 47, 43
  • 4, 4, 17, 21, 25, 18, 32, 50, 52, 52
  • 5, 12, 8, 20, 8, 28, 40, 48, 32, 32
  • 7, 12, 16, 14, 18, 34, 44, 41, 33, 45
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: Cl4 Cu16 F16 O52 P16 (Cl Cu4 F4 O13 P4)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 4, 17, 21, 25, 18, 32, 50, 52
  • 1, 4, 12, 8, 20, 8, 28, 40, 48, 32
  • 2, 9, 12, 21, 22, 23, 33, 46, 50, 44
  • 3, 12, 13, 21, 19, 28, 36, 46, 47, 43
  • 4, 4, 17, 21, 25, 18, 32, 50, 52, 52
  • 5, 12, 8, 20, 8, 28, 40, 48, 32, 32
  • 7, 12, 16, 14, 18, 34, 44, 41, 33, 45
span 1 {1 1 1}