Structure 7709998

7709962 << 7709998 >> 7709999
Original COD entry Download CIF Download DOT

Citation: Jiang, Lin-Tao; Li, Ming-Ze; Jiang, Xiao-Ming; Liu, Bin-Wen; Guo, Guo-Cong (2022). AIn4S6Cl (A = Rb and Cs) and Pb5Sn3Q10Cl2 (Q = S and Se): quaternary chalcohalides with mixed anionic coordination exhibit photocurrent responses. Dalton Transactions, , pp. -.

Formula: Cl2 In8 Rb2 S12

Cell parameters:

  • a = 6.6027(3) Å
  • b = 24.6116(13) Å
  • c = 7.5898(4) Å
  • α = 90°
  • β = 90.521(4)°
  • 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;0;1)

Dimensionality: 2

Formula: Cl2 In8 S12 (Cl In4 S6)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 6, 21, 25, 57, 41, 77, 48, 95
  • 3, 12, 15, 38, 33, 66, 43, 84, 54, 103
  • 3, 12, 16, 39, 31, 64, 44, 84, 54, 106
  • 3, 12, 16, 40, 33, 66, 42, 82, 54, 103
  • 3, 12, 16, 41, 32, 62, 43, 86, 54, 102
  • 4, 6, 21, 25, 57, 41, 77, 48, 95, 60
  • 4, 15, 18, 41, 30, 62, 42, 81, 54, 104
  • 5, 17, 19, 43, 30, 60, 42, 84, 54, 103
  • 6, 10, 27, 25, 53, 37, 75, 48, 90, 60
  • 6, 10, 28, 25, 52, 37, 75, 48, 90, 60
  • 6, 11, 30, 25, 52, 36, 70, 48, 97, 60
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: Cl2 In8 S12 (Cl In4 S6)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 6, 21, 25, 57, 41, 77, 48, 95
  • 3, 12, 15, 38, 33, 66, 43, 84, 54, 103
  • 3, 12, 16, 39, 31, 64, 44, 84, 54, 106
  • 3, 12, 16, 40, 33, 66, 42, 82, 54, 103
  • 3, 12, 16, 41, 32, 62, 43, 86, 54, 102
  • 4, 6, 21, 25, 57, 41, 77, 48, 95, 60
  • 4, 15, 18, 41, 30, 62, 42, 81, 54, 104
  • 5, 17, 19, 43, 30, 60, 42, 84, 54, 103
  • 6, 10, 27, 25, 53, 37, 75, 48, 90, 60
  • 6, 10, 28, 25, 52, 37, 75, 48, 90, 60
  • 6, 11, 30, 25, 52, 36, 70, 48, 97, 60
span 1 {1 1 1}