Structure 7115693

7115692 << 7115693 >> 7115696
Original COD entry Download CIF Download DOT

Citation: Lei Wang; Weiting Yang; Yangxue Li; Zhigang Xie; Wei Zhu; Zhong-Ming Sun (2014). Dynamically controlled one-pot synthesis of heterogeneous core-shell MOF single crystals using guest molecules. Chem.Commun., 50, pp. 11653-.

Formula: C14 H6 In N2 O8

Chemical name: ?

Cell parameters:

  • a = 15.7069(13) Å
  • b = 15.7069(13) Å
  • c = 52.887(9) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

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 6

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

Dimensionality: 2

Formula: C42 H18 In3 N6 O24 (C14 H6 In N2 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 8, 9, 9, 12, 12, 24
  • 1, 2, 3, 9, 10, 16, 14, 18, 12, 26
  • 1, 2, 4, 5, 4, 9, 12, 18, 15, 21
  • 1, 2, 4, 5, 7, 6, 13, 14, 21, 15
  • 1, 2, 4, 10, 8, 13, 14, 21, 15, 26
  • 2, 7, 7, 12, 9, 13, 8, 22, 26, 34
  • 2, 7, 9, 14, 11, 16, 11, 24, 26, 34
  • 3, 3, 7, 8, 9, 9, 12, 12, 24, 29
  • 3, 3, 9, 10, 16, 14, 18, 12, 26, 24
  • 3, 4, 5, 4, 9, 12, 18, 15, 21, 11
  • 3, 4, 5, 7, 6, 13, 14, 21, 15, 26
  • 3, 4, 10, 8, 13, 14, 21, 15, 26, 22
  • 3, 6, 4, 11, 13, 18, 15, 21, 11, 27
  • 3, 6, 7, 6, 10, 8, 16, 14, 27, 26
  • 3, 9, 9, 11, 8, 16, 14, 27, 26, 32
  • 6, 8, 12, 10, 14, 8, 22, 26, 34, 24
span 1 {1 1 1}

CIF datablock 1, entity 2 of 6

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

Dimensionality: 2

Formula: C42 H18 In3 N6 O24 (C14 H6 In N2 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 8, 9, 9, 12, 12, 24
  • 1, 2, 3, 9, 10, 16, 14, 18, 12, 26
  • 1, 2, 4, 5, 4, 9, 12, 18, 15, 21
  • 1, 2, 4, 5, 7, 6, 13, 14, 21, 15
  • 1, 2, 4, 10, 8, 13, 14, 21, 15, 26
  • 2, 7, 7, 12, 9, 13, 8, 22, 26, 34
  • 2, 7, 9, 14, 11, 16, 11, 24, 26, 34
  • 3, 3, 7, 8, 9, 9, 12, 12, 24, 29
  • 3, 3, 9, 10, 16, 14, 18, 12, 26, 24
  • 3, 4, 5, 4, 9, 12, 18, 15, 21, 11
  • 3, 4, 5, 7, 6, 13, 14, 21, 15, 26
  • 3, 4, 10, 8, 13, 14, 21, 15, 26, 22
  • 3, 6, 4, 11, 13, 18, 15, 21, 11, 27
  • 3, 6, 7, 6, 10, 8, 16, 14, 27, 26
  • 3, 9, 9, 11, 8, 16, 14, 27, 26, 32
  • 6, 8, 12, 10, 14, 8, 22, 26, 34, 24
span 1 {1 1 1}

CIF datablock 2, entity 3 of 6

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

Dimensionality: 2

Formula: C42 H18 In3 N6 O24 (C14 H6 In N2 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 8, 9, 9, 12, 12, 24
  • 1, 2, 3, 9, 10, 16, 14, 18, 12, 26
  • 1, 2, 4, 5, 4, 9, 12, 18, 15, 21
  • 1, 2, 4, 5, 7, 6, 13, 14, 21, 15
  • 1, 2, 4, 10, 8, 13, 14, 21, 15, 26
  • 2, 7, 7, 12, 9, 13, 8, 22, 26, 34
  • 2, 7, 9, 14, 11, 16, 11, 24, 26, 34
  • 3, 3, 7, 8, 9, 9, 12, 12, 24, 29
  • 3, 3, 9, 10, 16, 14, 18, 12, 26, 24
  • 3, 4, 5, 4, 9, 12, 18, 15, 21, 11
  • 3, 4, 5, 7, 6, 13, 14, 21, 15, 26
  • 3, 4, 10, 8, 13, 14, 21, 15, 26, 22
  • 3, 6, 4, 11, 13, 18, 15, 21, 11, 27
  • 3, 6, 7, 6, 10, 8, 16, 14, 27, 26
  • 3, 9, 9, 11, 8, 16, 14, 27, 26, 32
  • 6, 8, 12, 10, 14, 8, 22, 26, 34, 24
span 1 {1 1 1}

CIF datablock 3, entity 4 of 6

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

Dimensionality: 2

Formula: C42 H18 In3 N6 O24 (C14 H6 In N2 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 8, 9, 9, 12, 12, 24
  • 1, 2, 3, 9, 10, 16, 14, 18, 12, 26
  • 1, 2, 4, 5, 4, 9, 12, 18, 15, 21
  • 1, 2, 4, 5, 7, 6, 13, 14, 21, 15
  • 1, 2, 4, 10, 8, 13, 14, 21, 15, 26
  • 2, 7, 7, 12, 9, 13, 8, 22, 26, 34
  • 2, 7, 9, 14, 11, 16, 11, 24, 26, 34
  • 3, 3, 7, 8, 9, 9, 12, 12, 24, 29
  • 3, 3, 9, 10, 16, 14, 18, 12, 26, 24
  • 3, 4, 5, 4, 9, 12, 18, 15, 21, 11
  • 3, 4, 5, 7, 6, 13, 14, 21, 15, 26
  • 3, 4, 10, 8, 13, 14, 21, 15, 26, 22
  • 3, 6, 4, 11, 13, 18, 15, 21, 11, 27
  • 3, 6, 7, 6, 10, 8, 16, 14, 27, 26
  • 3, 9, 9, 11, 8, 16, 14, 27, 26, 32
  • 6, 8, 12, 10, 14, 8, 22, 26, 34, 24
span 1 {1 1 1}

CIF datablock 4, entity 5 of 6

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

Dimensionality: 2

Formula: C42 H18 In3 N6 O24 (C14 H6 In N2 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 8, 9, 9, 12, 12, 24
  • 1, 2, 3, 9, 10, 16, 14, 18, 12, 26
  • 1, 2, 4, 5, 4, 9, 12, 18, 15, 21
  • 1, 2, 4, 5, 7, 6, 13, 14, 21, 15
  • 1, 2, 4, 10, 8, 13, 14, 21, 15, 26
  • 2, 7, 7, 12, 9, 13, 8, 22, 26, 34
  • 2, 7, 9, 14, 11, 16, 11, 24, 26, 34
  • 3, 3, 7, 8, 9, 9, 12, 12, 24, 29
  • 3, 3, 9, 10, 16, 14, 18, 12, 26, 24
  • 3, 4, 5, 4, 9, 12, 18, 15, 21, 11
  • 3, 4, 5, 7, 6, 13, 14, 21, 15, 26
  • 3, 4, 10, 8, 13, 14, 21, 15, 26, 22
  • 3, 6, 4, 11, 13, 18, 15, 21, 11, 27
  • 3, 6, 7, 6, 10, 8, 16, 14, 27, 26
  • 3, 9, 9, 11, 8, 16, 14, 27, 26, 32
  • 6, 8, 12, 10, 14, 8, 22, 26, 34, 24
span 1 {1 1 1}

CIF datablock 5, entity 6 of 6

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

Dimensionality: 2

Formula: C42 H18 In3 N6 O24 (C14 H6 In N2 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 8, 9, 9, 12, 12, 24
  • 1, 2, 3, 9, 10, 16, 14, 18, 12, 26
  • 1, 2, 4, 5, 4, 9, 12, 18, 15, 21
  • 1, 2, 4, 5, 7, 6, 13, 14, 21, 15
  • 1, 2, 4, 10, 8, 13, 14, 21, 15, 26
  • 2, 7, 7, 12, 9, 13, 8, 22, 26, 34
  • 2, 7, 9, 14, 11, 16, 11, 24, 26, 34
  • 3, 3, 7, 8, 9, 9, 12, 12, 24, 29
  • 3, 3, 9, 10, 16, 14, 18, 12, 26, 24
  • 3, 4, 5, 4, 9, 12, 18, 15, 21, 11
  • 3, 4, 5, 7, 6, 13, 14, 21, 15, 26
  • 3, 4, 10, 8, 13, 14, 21, 15, 26, 22
  • 3, 6, 4, 11, 13, 18, 15, 21, 11, 27
  • 3, 6, 7, 6, 10, 8, 16, 14, 27, 26
  • 3, 9, 9, 11, 8, 16, 14, 27, 26, 32
  • 6, 8, 12, 10, 14, 8, 22, 26, 34, 24
span 1 {1 1 1}