Structure 4519274

4519253 << 4519274 >> 4519275
Original COD entry Download CIF Download DOT

Citation: Li, Dong; Shang, Xiaoying; Wu, Wentao; Li, Xiaoqi; Xu, Zhijin; Li, Lina; Hong, Maochun; Chen, Xueyuan; Luo, Junhua (2022). Unprecedented Self-Powered Visible-Infrared Dual-Modal Photodetection Induced by a Bulk Photovoltaic Effect in a Polar Perovskite.. ACS applied materials & interfaces, 14, pp. 5608-5614.

Formula: C12 H38 Br12 N4 Pb3

Cell parameters:

  • a = 53.477(4) Å
  • b = 8.4509(6) Å
  • c = 8.4407(5) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: interleaving

List: 1-2D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 16, entity 17 of 6

Basis: (0;0;1)

Dimensionality: 1

Formula: Br8 Pb2 (Br4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 17, entity 18 of 6

Basis: (0;0;1)

Dimensionality: 1

Formula: Br8 Pb2 (Br4 Pb)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 18, entity 19 of 6

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

Dimensionality: 2

Formula: Br6 Pb2 (Br3 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 4, 16, 8, 28, 12, 40, 16, 52
  • 2, 8, 6, 22, 10, 34, 14, 46, 18, 58
  • 5, 4, 16, 8, 28, 12, 40, 16, 52, 20
span 1 {1 1 1}

CIF datablock 19, entity 20 of 6

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

Dimensionality: 2

Formula: Br6 Pb2 (Br3 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 4, 16, 8, 28, 12, 40, 16, 52
  • 2, 8, 6, 22, 10, 34, 14, 46, 18, 58
  • 5, 4, 16, 8, 28, 12, 40, 16, 52, 20
span 1 {1 1 1}

CIF datablock 20, entity 21 of 6

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

Dimensionality: 2

Formula: Br6 Pb2 (Br3 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 4, 16, 8, 28, 12, 40, 16, 52
  • 2, 8, 6, 22, 10, 34, 14, 46, 18, 58
  • 5, 4, 16, 8, 28, 12, 40, 16, 52, 20
span 1 {1 1 1}

CIF datablock 21, entity 22 of 6

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

Dimensionality: 2

Formula: Br6 Pb2 (Br3 Pb)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 4, 16, 8, 28, 12, 40, 16, 52
  • 2, 8, 6, 22, 10, 34, 14, 46, 18, 58
  • 5, 4, 16, 8, 28, 12, 40, 16, 52, 20
span 1 {1 1 1}