Structure 7243726

7243706 << 7243726 >> 7243727
Original COD entry Download CIF Download DOT

Citation: Islam, Md Faizul; Sindt, Ammon J.; Hossain, Muhammad Saddam; Ayare, Pooja J.; Smith, Mark D.; Vannucci, Aaron K.; Garashchuk, Sophya; Shimizu, Linda S. (2021). Assembled triphenylamine bis-urea macrocycles: Exploring photodriven electron transfer from host to guests. . Physical Chemistry Chemical Physics, , pp. -.

Formula: C45 H38 Br2 N7 O2 S0.5

Cell parameters:

  • a = 15.8195(17) Å
  • b = 4.6302(5) Å
  • c = 26.812(3) Å
  • α = 90°
  • β = 100.182(2)°
  • γ = 90°

List type: interleaving

List: 1D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 2, entity 3 of 2

Basis: (0;1;0)

Dimensionality: 1

Formula: C6 H4 N2 S (C6 H4 N2 S)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 6, 8, 8, 6, 8, 6, 6, 6
  • 1, 3, 6, 7, 7, 9, 6, 5, 6, 9
  • 2, 5, 5, 7, 10, 7, 5, 5, 9, 7
  • 2, 7, 6, 9, 7, 6, 8, 7, 5, 6
  • 3, 6, 8, 8, 6, 8, 6, 6, 6, 8
  • 3, 7, 9, 6, 5, 8, 8, 5, 5, 8
  • 4, 6, 6, 8, 6, 6, 6, 8, 6, 6
  • 4, 6, 7, 7, 8, 7, 5, 6, 8, 7
  • 4, 6, 7, 7, 9, 6, 5, 6, 9, 6
  • 4, 7, 9, 6, 5, 6, 9, 6, 5, 6
  • 5, 6, 5, 6, 9, 6, 5, 6, 9, 6
  • 5, 7, 6, 8, 6, 6, 6, 8, 6, 6
  • 6, 4, 6, 9, 8, 5, 5, 8, 8, 5
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CIF datablock 3, entity 4 of 2

Basis: (0;1;0)

Dimensionality: 1

Formula: C6 H4 N2 S (C6 H4 N2 S)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 6, 8, 8, 6, 8, 6, 6, 6
  • 1, 3, 6, 7, 7, 9, 6, 5, 6, 9
  • 2, 5, 5, 7, 10, 7, 5, 5, 9, 7
  • 2, 7, 6, 9, 7, 6, 8, 7, 5, 6
  • 3, 6, 8, 8, 6, 8, 6, 6, 6, 8
  • 3, 7, 9, 6, 5, 8, 8, 5, 5, 8
  • 4, 6, 6, 8, 6, 6, 6, 8, 6, 6
  • 4, 6, 7, 7, 8, 7, 5, 6, 8, 7
  • 4, 6, 7, 7, 9, 6, 5, 6, 9, 6
  • 4, 7, 9, 6, 5, 6, 9, 6, 5, 6
  • 5, 6, 5, 6, 9, 6, 5, 6, 9, 6
  • 5, 7, 6, 8, 6, 6, 6, 8, 6, 6
  • 6, 4, 6, 9, 8, 5, 5, 8, 8, 5
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