Structure 4003403

4003402 << 4003403 >> 4003404
Original COD entry Download CIF Download DOT

Citation: Oswald, Iain W. H.; Koegel, Alexandra A.; Neilson, James R. (2018). General Synthesis Principles for Ruddlesden--Popper Hybrid Perovskite Halides from a Dynamic Equilibrium. Chemistry of Materials, 30, pp. 8606-.

Formula: C14 H24 I8 N2 O2 Pb3

Cell parameters:

  • a = 27.623(3) Å
  • b = 54.155(5) Å
  • c = 4.6034(5) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 1D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 16, entity 17 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 17, entity 18 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 18, entity 19 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 19, entity 20 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 20, entity 21 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 21, entity 22 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 22, entity 23 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 23, entity 24 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I4 Pb (I4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 24, entity 25 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 25, entity 26 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 26, entity 27 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 27, entity 28 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 28, entity 29 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 29, entity 30 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 30, entity 31 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 31, entity 32 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 32, entity 33 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 33, entity 34 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 34, entity 35 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 35, entity 36 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 36, entity 37 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 37, entity 38 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 38, entity 39 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}

CIF datablock 39, entity 40 of 24

Basis: (0;0;1)

Dimensionality: 1

Formula: I2 Pb (I2 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 4, 2, 4, 2, 4, 2, 4
  • 2, 4, 2, 4, 2, 4, 2, 4, 2, 4
  • 3, 2, 4, 2, 4, 2, 4, 2, 4, 2
span 1 {1 1 1}