Structure 4344946

4344943 << 4344946 >> 4344947
Original COD entry Download CIF Download DOT

Citation: Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G. (2017). Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites.. Inorganic chemistry, 56, pp. 56-73.

Formula: C9 H30 I7 N3 Sn2

Chemical name: ?

Cell parameters:

  • a = 8.9525(3) Å
  • b = 8.9525(3) Å
  • c = 36.5514(15) 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 8, entity 9 of 4

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

Dimensionality: 2

Formula: I5 Sn2 (I5 Sn2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 18, 9, 24, 12, 33
  • 2, 6, 4, 12, 8, 22, 10, 28, 14, 36
  • 4, 3, 9, 6, 18, 9, 24, 12, 33, 15
span 1 {1 1 1}

CIF datablock 9, entity 10 of 4

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

Dimensionality: 2

Formula: I5 Sn2 (I5 Sn2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 18, 9, 24, 12, 33
  • 2, 6, 4, 12, 8, 22, 10, 28, 14, 36
  • 4, 3, 9, 6, 18, 9, 24, 12, 33, 15
span 1 {1 1 1}

CIF datablock 10, entity 11 of 4

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

Dimensionality: 2

Formula: I5 Sn2 (I5 Sn2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 18, 9, 24, 12, 33
  • 2, 6, 4, 12, 8, 22, 10, 28, 14, 36
  • 4, 3, 9, 6, 18, 9, 24, 12, 33, 15
span 1 {1 1 1}

CIF datablock 11, entity 12 of 4

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

Dimensionality: 2

Formula: I5 Sn2 (I5 Sn2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 18, 9, 24, 12, 33
  • 2, 6, 4, 12, 8, 22, 10, 28, 14, 36
  • 4, 3, 9, 6, 18, 9, 24, 12, 33, 15
span 1 {1 1 1}