Structure 7117573

7117572 << 7117573 >> 7117574
Original COD entry Download CIF Download DOT

Citation: Mart\'i-Rujas, Javier; Bonafede, Simone; Tushi, Dorearta; Cametti, Massimo (2015). Multiple single-crystal-to-single-crystal guest exchange in a dynamic 1D coordination polymer.. Chemical communications (Cambridge, England), 51, pp. 12357-12360.

Formula: C62 H60 Cl8 N8 Zn2

Chemical name: ?

Cell parameters:

  • a = 14.6639(9) Å
  • b = 22.7525(14) Å
  • c = 9.8535(6) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 1D

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: (0;1;-1)

Dimensionality: 1

Formula: C30 H28 Cl2 N4 Zn (C30 H28 Cl2 N4 Zn)

span 1 {1 1 1}

CIF datablock 1, entity 2 of 6

Basis: (0;1;1)

Dimensionality: 1

Formula: C30 H28 Cl2 N4 Zn (C30 H28 Cl2 N4 Zn)

span 1 {1 1 1}

CIF datablock 2, entity 3 of 6

Basis: (0;1;-1)

Dimensionality: 1

Formula: C30 H28 Cl2 N4 Zn (C30 H28 Cl2 N4 Zn)

span 1 {1 1 1}

CIF datablock 3, entity 4 of 6

Basis: (0;1;1)

Dimensionality: 1

Formula: C30 H28 Cl2 N4 Zn (C30 H28 Cl2 N4 Zn)

span 1 {1 1 1}

CIF datablock 4, entity 5 of 6

Basis: (1;0;0)

Dimensionality: 1

Formula: C12 H24 Cl24 (C H2 Cl2)

Multiplicity: 1

Coordination sequences:

  • 1, 9, 11, 11, 14, 15, 13, 9, 10, 13
  • 2, 12, 9, 18, 9, 11, 13, 9, 18, 9
  • 3, 13, 10, 17, 9, 17, 8, 9, 17, 9
  • 5, 11, 10, 17, 9, 17, 8, 9, 17, 9
  • 5, 14, 12, 13, 9, 18, 9, 11, 13, 9
  • 5, 17, 11, 12, 15, 12, 15, 6, 12, 15
  • 5, 20, 11, 14, 10, 6, 19, 11, 14, 10
  • 6, 12, 18, 13, 11, 12, 8, 16, 13, 11
  • 6, 14, 11, 13, 9, 18, 9, 11, 13, 9
  • 7, 13, 12, 14, 15, 13, 9, 10, 13, 15
  • 8, 18, 7, 12, 15, 12, 15, 6, 12, 15
  • 10, 11, 11, 14, 15, 13, 9, 10, 13, 15
  • 10, 12, 17, 8, 9, 17, 9, 17, 8, 9
  • 12, 8, 16, 13, 11, 12, 8, 16, 13, 11
  • 12, 11, 10, 13, 15, 13, 9, 10, 13, 15
span 1 {1 1 1}

CIF datablock 5, entity 6 of 6

Basis: (1;0;0)

Dimensionality: 1

Formula: C12 H24 Cl24 (C H2 Cl2)

Multiplicity: 1

Coordination sequences:

  • 1, 9, 11, 11, 14, 15, 13, 9, 10, 13
  • 2, 12, 9, 18, 9, 11, 13, 9, 18, 9
  • 3, 13, 10, 17, 9, 17, 8, 9, 17, 9
  • 5, 11, 10, 17, 9, 17, 8, 9, 17, 9
  • 5, 14, 12, 13, 9, 18, 9, 11, 13, 9
  • 5, 17, 11, 12, 15, 12, 15, 6, 12, 15
  • 5, 20, 11, 14, 10, 6, 19, 11, 14, 10
  • 6, 12, 18, 13, 11, 12, 8, 16, 13, 11
  • 6, 14, 11, 13, 9, 18, 9, 11, 13, 9
  • 7, 13, 12, 14, 15, 13, 9, 10, 13, 15
  • 8, 18, 7, 12, 15, 12, 15, 6, 12, 15
  • 10, 11, 11, 14, 15, 13, 9, 10, 13, 15
  • 10, 12, 17, 8, 9, 17, 9, 17, 8, 9
  • 12, 8, 16, 13, 11, 12, 8, 16, 13, 11
  • 12, 11, 10, 13, 15, 13, 9, 10, 13, 15
span 1 {1 1 1}