Structure 7007152

7007145 << 7007152 >> 7007153
Original COD entry Download CIF Download DOT

Citation: Shatruk, Mikhail; Chouai, Abdellatif; Dunbar, Kim R. (2006). Influence of anions on the dimensionality of extended networks based on Cu I cations and 1,4,5,8,9,12-hexaazatriphenylene (HAT) ligands.. Dalton transactions (Cambridge, England : 2003), , pp. 2184-2191.

Formula: C44.86 H31.08 B3 Cu3 F12 N20.86 O6.02

Cell parameters:

  • a = 16.766(12) Å
  • b = 13.565(13) Å
  • c = 24.967(19) Å
  • α = 90.00°
  • β = 103.80(4)°
  • γ = 90.00°

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 0, entity 1 of 2

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

Dimensionality: 2

Formula: C72 H36 Cu6 N36 (C12 H6 Cu N6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 2, 3, 4, 6, 9, 13, 18
  • 1, 2, 3, 2, 3, 5, 9, 13, 17, 18
  • 1, 2, 3, 3, 6, 8, 11, 9, 8, 15
  • 1, 2, 3, 3, 6, 8, 12, 11, 10, 17
  • 1, 2, 3, 3, 7, 10, 16, 15, 13, 18
  • 1, 2, 4, 5, 7, 11, 10, 9, 14, 22
  • 1, 2, 4, 5, 7, 11, 10, 10, 16, 24
  • 1, 2, 4, 6, 9, 15, 15, 13, 17, 23
  • 1, 2, 4, 6, 10, 15, 17, 13, 14, 24
  • 1, 2, 4, 6, 10, 15, 17, 13, 15, 25
  • 1, 2, 4, 6, 11, 17, 20, 16, 16, 24
  • 1, 2, 4, 6, 11, 17, 21, 17, 17, 24
  • 1, 2, 4, 6, 11, 17, 21, 17, 18, 26
  • 1, 2, 4, 6, 11, 19, 21, 18, 15, 22
  • 1, 2, 4, 7, 12, 19, 21, 16, 16, 24
  • 1, 2, 4, 7, 12, 19, 22, 17, 17, 24
  • 1, 2, 4, 7, 12, 19, 22, 17, 17, 25
  • 1, 2, 4, 7, 14, 20, 23, 15, 14, 23
  • 2, 4, 5, 4, 6, 9, 13, 18, 18, 11
  • 2, 4, 5, 5, 6, 8, 11, 14, 16, 19
  • 2, 4, 5, 5, 7, 10, 13, 16, 15, 16
  • 2, 4, 5, 5, 8, 11, 15, 17, 15, 16
  • 2, 4, 5, 5, 9, 13, 17, 18, 13, 14
  • 3, 3, 2, 3, 4, 6, 9, 13, 18, 18
  • 3, 3, 2, 3, 5, 9, 13, 17, 18, 13
  • 3, 3, 3, 6, 8, 11, 9, 8, 15, 24
  • 3, 3, 3, 6, 8, 12, 11, 10, 17, 23
  • 3, 3, 3, 7, 10, 16, 15, 13, 18, 23
  • 3, 4, 5, 7, 11, 10, 9, 14, 22, 27
  • 3, 4, 5, 7, 11, 10, 10, 16, 24, 28
  • 3, 4, 6, 9, 15, 15, 13, 17, 23, 25
  • 3, 4, 6, 10, 15, 17, 13, 14, 24, 31
  • 3, 4, 6, 10, 15, 17, 13, 15, 25, 31
  • 3, 4, 6, 11, 17, 20, 16, 16, 24, 33
  • 3, 4, 6, 11, 17, 21, 17, 17, 24, 29
  • 3, 4, 6, 11, 17, 21, 17, 18, 26, 31
  • 3, 4, 6, 11, 19, 21, 18, 15, 22, 32
  • 3, 4, 7, 12, 19, 21, 16, 16, 24, 31
  • 3, 4, 7, 12, 19, 22, 17, 17, 24, 27
  • 3, 4, 7, 12, 19, 22, 17, 17, 25, 29
  • 3, 4, 7, 14, 20, 23, 15, 14, 23, 30
  • 3, 5, 6, 7, 9, 13, 18, 18, 11, 17
  • 3, 5, 7, 7, 8, 11, 14, 16, 19, 19
  • 3, 5, 7, 8, 10, 13, 16, 15, 16, 24
  • 3, 5, 7, 9, 11, 15, 17, 15, 16, 24
  • 3, 5, 7, 10, 13, 17, 18, 13, 14, 23
  • 3, 6, 8, 10, 12, 13, 14, 18, 21, 28
  • 3, 6, 8, 10, 13, 15, 16, 19, 19, 26
  • 3, 6, 9, 12, 15, 16, 15, 18, 21, 26
  • 3, 6, 9, 12, 15, 17, 15, 16, 24, 33
  • 3, 6, 9, 12, 16, 19, 19, 19, 22, 30
  • 3, 6, 9, 12, 16, 19, 19, 20, 23, 30
  • 3, 6, 9, 13, 17, 19, 16, 14, 22, 32
  • 3, 6, 9, 13, 17, 21, 20, 19, 21, 29
  • 3, 6, 9, 13, 17, 21, 20, 20, 23, 30
  • 3, 6, 10, 13, 17, 18, 15, 16, 24, 31
  • 3, 6, 10, 14, 19, 22, 20, 19, 21, 27
  • 3, 6, 10, 14, 19, 22, 20, 19, 22, 28
  • 3, 6, 11, 15, 19, 19, 13, 14, 23, 30
  • 3, 7, 9, 11, 10, 9, 14, 22, 27, 26
  • 3, 7, 9, 11, 10, 10, 16, 24, 28, 24
  • 3, 7, 9, 12, 12, 12, 18, 23, 25, 29
  • 3, 7, 9, 12, 12, 12, 18, 24, 24, 25
  • 3, 7, 9, 12, 12, 12, 19, 26, 26, 25
  • 3, 7, 9, 12, 13, 13, 20, 25, 24, 24
  • 3, 7, 9, 12, 13, 13, 21, 27, 26, 25
  • 3, 7, 9, 12, 13, 14, 20, 24, 23, 27
  • 3, 8, 11, 15, 15, 13, 17, 23, 25, 22
  • 3, 8, 11, 16, 16, 15, 19, 23, 23, 25
  • 3, 8, 11, 16, 17, 16, 21, 25, 22, 20
  • 3, 8, 11, 16, 17, 16, 21, 25, 22, 21
  • 3, 8, 13, 17, 18, 14, 17, 22, 22, 25
  • 4, 8, 12, 12, 7, 12, 20, 26, 28, 20
  • 4, 8, 12, 12, 7, 13, 22, 28, 29, 18
  • 5, 10, 16, 17, 12, 16, 23, 25, 24, 14
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: C72 H36 Cu6 N36 (C12 H6 Cu N6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 2, 3, 4, 6, 9, 13, 18
  • 1, 2, 3, 2, 3, 5, 9, 13, 17, 18
  • 1, 2, 3, 3, 6, 8, 11, 9, 8, 15
  • 1, 2, 3, 3, 6, 8, 12, 11, 10, 17
  • 1, 2, 3, 3, 7, 10, 16, 15, 13, 18
  • 1, 2, 4, 5, 7, 11, 10, 9, 14, 22
  • 1, 2, 4, 5, 7, 11, 10, 10, 16, 24
  • 1, 2, 4, 6, 9, 15, 15, 13, 17, 23
  • 1, 2, 4, 6, 10, 15, 17, 13, 14, 24
  • 1, 2, 4, 6, 10, 15, 17, 13, 15, 25
  • 1, 2, 4, 6, 11, 17, 20, 16, 16, 24
  • 1, 2, 4, 6, 11, 17, 21, 17, 17, 24
  • 1, 2, 4, 6, 11, 17, 21, 17, 18, 26
  • 1, 2, 4, 6, 11, 19, 21, 18, 15, 22
  • 1, 2, 4, 7, 12, 19, 21, 16, 16, 24
  • 1, 2, 4, 7, 12, 19, 22, 17, 17, 24
  • 1, 2, 4, 7, 12, 19, 22, 17, 17, 25
  • 1, 2, 4, 7, 14, 20, 23, 15, 14, 23
  • 2, 4, 5, 4, 6, 9, 13, 18, 18, 11
  • 2, 4, 5, 5, 6, 8, 11, 14, 16, 19
  • 2, 4, 5, 5, 7, 10, 13, 16, 15, 16
  • 2, 4, 5, 5, 8, 11, 15, 17, 15, 16
  • 2, 4, 5, 5, 9, 13, 17, 18, 13, 14
  • 3, 3, 2, 3, 4, 6, 9, 13, 18, 18
  • 3, 3, 2, 3, 5, 9, 13, 17, 18, 13
  • 3, 3, 3, 6, 8, 11, 9, 8, 15, 24
  • 3, 3, 3, 6, 8, 12, 11, 10, 17, 23
  • 3, 3, 3, 7, 10, 16, 15, 13, 18, 23
  • 3, 4, 5, 7, 11, 10, 9, 14, 22, 27
  • 3, 4, 5, 7, 11, 10, 10, 16, 24, 28
  • 3, 4, 6, 9, 15, 15, 13, 17, 23, 25
  • 3, 4, 6, 10, 15, 17, 13, 14, 24, 31
  • 3, 4, 6, 10, 15, 17, 13, 15, 25, 31
  • 3, 4, 6, 11, 17, 20, 16, 16, 24, 33
  • 3, 4, 6, 11, 17, 21, 17, 17, 24, 29
  • 3, 4, 6, 11, 17, 21, 17, 18, 26, 31
  • 3, 4, 6, 11, 19, 21, 18, 15, 22, 32
  • 3, 4, 7, 12, 19, 21, 16, 16, 24, 31
  • 3, 4, 7, 12, 19, 22, 17, 17, 24, 27
  • 3, 4, 7, 12, 19, 22, 17, 17, 25, 29
  • 3, 4, 7, 14, 20, 23, 15, 14, 23, 30
  • 3, 5, 6, 7, 9, 13, 18, 18, 11, 17
  • 3, 5, 7, 7, 8, 11, 14, 16, 19, 19
  • 3, 5, 7, 8, 10, 13, 16, 15, 16, 24
  • 3, 5, 7, 9, 11, 15, 17, 15, 16, 24
  • 3, 5, 7, 10, 13, 17, 18, 13, 14, 23
  • 3, 6, 8, 10, 12, 13, 14, 18, 21, 28
  • 3, 6, 8, 10, 13, 15, 16, 19, 19, 26
  • 3, 6, 9, 12, 15, 16, 15, 18, 21, 26
  • 3, 6, 9, 12, 15, 17, 15, 16, 24, 33
  • 3, 6, 9, 12, 16, 19, 19, 19, 22, 30
  • 3, 6, 9, 12, 16, 19, 19, 20, 23, 30
  • 3, 6, 9, 13, 17, 19, 16, 14, 22, 32
  • 3, 6, 9, 13, 17, 21, 20, 19, 21, 29
  • 3, 6, 9, 13, 17, 21, 20, 20, 23, 30
  • 3, 6, 10, 13, 17, 18, 15, 16, 24, 31
  • 3, 6, 10, 14, 19, 22, 20, 19, 21, 27
  • 3, 6, 10, 14, 19, 22, 20, 19, 22, 28
  • 3, 6, 11, 15, 19, 19, 13, 14, 23, 30
  • 3, 7, 9, 11, 10, 9, 14, 22, 27, 26
  • 3, 7, 9, 11, 10, 10, 16, 24, 28, 24
  • 3, 7, 9, 12, 12, 12, 18, 23, 25, 29
  • 3, 7, 9, 12, 12, 12, 18, 24, 24, 25
  • 3, 7, 9, 12, 12, 12, 19, 26, 26, 25
  • 3, 7, 9, 12, 13, 13, 20, 25, 24, 24
  • 3, 7, 9, 12, 13, 13, 21, 27, 26, 25
  • 3, 7, 9, 12, 13, 14, 20, 24, 23, 27
  • 3, 8, 11, 15, 15, 13, 17, 23, 25, 22
  • 3, 8, 11, 16, 16, 15, 19, 23, 23, 25
  • 3, 8, 11, 16, 17, 16, 21, 25, 22, 20
  • 3, 8, 11, 16, 17, 16, 21, 25, 22, 21
  • 3, 8, 13, 17, 18, 14, 17, 22, 22, 25
  • 4, 8, 12, 12, 7, 12, 20, 26, 28, 20
  • 4, 8, 12, 12, 7, 13, 22, 28, 29, 18
  • 5, 10, 16, 17, 12, 16, 23, 25, 24, 14
span 1 {1 1 1}