Structure 8000447

8000428 << 8000447 >> 8000451
Original COD entry Download CIF Download DOT

Citation: Morrow, Darien J.; Hautzinger, Matthew P.; Lafayette, David P.; Scheeler, Jason M.; Dang, Lianna; Leng, Meiying; Kohler, Daniel D.; Wheaton, Amelia M.; Fu, Yongping; Guzei, Ilia A.; Tang, Jiang; Jin, Song; Wright, John C. (2020). Disentangling Second Harmonic Generation from Multiphoton Photoluminescence in Halide Perovskites using Multidimensional Harmonic Generation.. The journal of physical chemistry letters, , pp. 6551-6559.

Formula: C17 H30 I7 N3 Pb2

Cell parameters:

  • a = 8.722(3) Å
  • b = 8.726(3) Å
  • c = 22.533(8) Å
  • α = 97.604(16)°
  • β = 93.482(11)°
  • γ = 90.36(2)°

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 0, entity 1 of 3

Basis: (1;1;0)

Dimensionality: 1

Formula: C31 H45 N3 (C31 H45 N3)

span 1 {1 1 1}

CIF datablock 1, entity 2 of 3

Basis: (1;1;0)

Dimensionality: 1

Formula: C31 H45 N3 (C31 H45 N3)

span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

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

Dimensionality: 2

Formula: I22 Pb4 (I11 Pb2)

Multiplicity: 1

span 1 {1 1 1}