Structure 4517555

4517545 << 4517555 >> 4517556
Original COD entry Download CIF Download DOT

Citation: Kan, Liang; Li, Guanghua; Liu, Yunling (2020). Highly Selective Separation of C3H8 and C2H2 over CH4 within Two Water-Stable Zn5 Cluster-Based Metal-Organic Frameworks.. ACS applied materials & interfaces, , pp. -.

Formula: C42 H44 N20 O12 Zn5

Cell parameters:

  • a = 12.219(2) Å
  • b = 15.700(3) Å
  • c = 15.737(3) Å
  • α = 101.19(3)°
  • β = 97.41(3)°
  • γ = 92.52(3)°

List type: interleaving

List: 3D

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

Dimensionality: 3

Formula: C34 H22 N18 O9 Zn5 (C34 H22 N18 O9 Zn5)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 9, 15, 14, 16, 18, 26
  • 1, 2, 3, 7, 9, 15, 14, 17, 18, 26
  • 1, 2, 3, 8, 9, 15, 14, 15, 18, 26
  • 1, 2, 4, 3, 5, 8, 6, 10, 4, 13
  • 1, 2, 4, 5, 5, 5, 9, 5, 11, 14
  • 1, 2, 4, 5, 5, 5, 9, 5, 12, 14
  • 1, 2, 4, 5, 11, 15, 14, 13, 9, 12
  • 1, 2, 4, 5, 12, 15, 14, 12, 9, 12
  • 1, 2, 4, 6, 11, 15, 14, 12, 9, 12
  • 1, 2, 4, 7, 3, 8, 16, 23, 21, 24
  • 1, 2, 4, 7, 3, 9, 16, 23, 21, 23
  • 1, 2, 4, 7, 6, 8, 10, 17, 18, 25
  • 1, 2, 4, 7, 6, 8, 10, 18, 18, 25
  • 1, 2, 4, 7, 6, 9, 10, 17, 18, 24
  • 1, 2, 4, 7, 9, 6, 10, 4, 13, 24
  • 1, 4, 7, 12, 11, 13, 12, 17, 11, 18
  • 2, 5, 8, 14, 12, 15, 14, 18, 15, 26
  • 2, 5, 8, 14, 12, 15, 14, 19, 15, 26
  • 2, 6, 8, 14, 12, 14, 14, 18, 15, 26
  • 3, 3, 7, 9, 15, 14, 16, 18, 26, 18
  • 3, 3, 7, 9, 15, 14, 17, 18, 26, 18
  • 3, 3, 8, 9, 15, 14, 15, 18, 26, 18
  • 3, 4, 3, 5, 8, 6, 10, 4, 13, 24
  • 3, 4, 5, 5, 5, 9, 5, 11, 14, 27
  • 3, 4, 5, 5, 5, 9, 5, 12, 14, 26
  • 3, 4, 5, 11, 15, 14, 13, 9, 12, 14
  • 3, 4, 5, 12, 15, 14, 12, 9, 12, 14
  • 3, 4, 6, 11, 15, 14, 12, 9, 12, 14
  • 3, 4, 7, 3, 8, 16, 23, 21, 24, 21
  • 3, 4, 7, 3, 9, 16, 23, 21, 23, 21
  • 3, 4, 7, 6, 8, 10, 17, 18, 25, 20
  • 3, 4, 7, 6, 8, 10, 18, 18, 25, 20
  • 3, 4, 7, 6, 9, 10, 17, 18, 24, 20
  • 3, 4, 7, 9, 6, 10, 4, 13, 24, 40
  • 3, 6, 4, 8, 11, 16, 18, 24, 21, 27
  • 3, 6, 4, 8, 11, 17, 18, 24, 21, 26
  • 3, 6, 4, 9, 11, 16, 18, 23, 21, 27
  • 3, 6, 7, 6, 9, 5, 11, 14, 27, 30
  • 3, 6, 7, 6, 9, 5, 12, 14, 26, 30
  • 3, 6, 7, 8, 5, 10, 15, 25, 20, 27
  • 3, 6, 7, 8, 5, 11, 15, 25, 20, 25
  • 3, 7, 10, 15, 13, 15, 7, 13, 12, 19
  • 3, 7, 10, 15, 13, 15, 7, 13, 12, 20
  • 3, 7, 10, 16, 13, 14, 7, 13, 12, 19
  • 3, 7, 10, 16, 13, 14, 7, 13, 12, 20
  • 3, 8, 10, 15, 13, 14, 7, 13, 12, 19
  • 3, 9, 14, 14, 17, 6, 12, 10, 18, 16
  • 3, 9, 15, 14, 16, 6, 12, 10, 18, 16
  • 4, 7, 12, 11, 14, 12, 17, 11, 18, 18
  • 4, 7, 12, 11, 14, 12, 17, 11, 19, 18
  • 5, 7, 12, 11, 13, 12, 17, 11, 18, 18
  • 6, 12, 16, 17, 4, 8, 8, 16, 12, 20
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 3

Formula: C34 H22 N18 O9 Zn5 (C34 H22 N18 O9 Zn5)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 7, 9, 15, 14, 16, 18, 26
  • 1, 2, 3, 7, 9, 15, 14, 17, 18, 26
  • 1, 2, 3, 8, 9, 15, 14, 15, 18, 26
  • 1, 2, 4, 3, 5, 8, 6, 10, 4, 13
  • 1, 2, 4, 5, 5, 5, 9, 5, 11, 14
  • 1, 2, 4, 5, 5, 5, 9, 5, 12, 14
  • 1, 2, 4, 5, 11, 15, 14, 13, 9, 12
  • 1, 2, 4, 5, 12, 15, 14, 12, 9, 12
  • 1, 2, 4, 6, 11, 15, 14, 12, 9, 12
  • 1, 2, 4, 7, 3, 8, 16, 23, 21, 24
  • 1, 2, 4, 7, 3, 9, 16, 23, 21, 23
  • 1, 2, 4, 7, 6, 8, 10, 17, 18, 25
  • 1, 2, 4, 7, 6, 8, 10, 18, 18, 25
  • 1, 2, 4, 7, 6, 9, 10, 17, 18, 24
  • 1, 2, 4, 7, 9, 6, 10, 4, 13, 24
  • 1, 4, 7, 12, 11, 13, 12, 17, 11, 18
  • 2, 5, 8, 14, 12, 15, 14, 18, 15, 26
  • 2, 5, 8, 14, 12, 15, 14, 19, 15, 26
  • 2, 6, 8, 14, 12, 14, 14, 18, 15, 26
  • 3, 3, 7, 9, 15, 14, 16, 18, 26, 18
  • 3, 3, 7, 9, 15, 14, 17, 18, 26, 18
  • 3, 3, 8, 9, 15, 14, 15, 18, 26, 18
  • 3, 4, 3, 5, 8, 6, 10, 4, 13, 24
  • 3, 4, 5, 5, 5, 9, 5, 11, 14, 27
  • 3, 4, 5, 5, 5, 9, 5, 12, 14, 26
  • 3, 4, 5, 11, 15, 14, 13, 9, 12, 14
  • 3, 4, 5, 12, 15, 14, 12, 9, 12, 14
  • 3, 4, 6, 11, 15, 14, 12, 9, 12, 14
  • 3, 4, 7, 3, 8, 16, 23, 21, 24, 21
  • 3, 4, 7, 3, 9, 16, 23, 21, 23, 21
  • 3, 4, 7, 6, 8, 10, 17, 18, 25, 20
  • 3, 4, 7, 6, 8, 10, 18, 18, 25, 20
  • 3, 4, 7, 6, 9, 10, 17, 18, 24, 20
  • 3, 4, 7, 9, 6, 10, 4, 13, 24, 40
  • 3, 6, 4, 8, 11, 16, 18, 24, 21, 27
  • 3, 6, 4, 8, 11, 17, 18, 24, 21, 26
  • 3, 6, 4, 9, 11, 16, 18, 23, 21, 27
  • 3, 6, 7, 6, 9, 5, 11, 14, 27, 30
  • 3, 6, 7, 6, 9, 5, 12, 14, 26, 30
  • 3, 6, 7, 8, 5, 10, 15, 25, 20, 27
  • 3, 6, 7, 8, 5, 11, 15, 25, 20, 25
  • 3, 7, 10, 15, 13, 15, 7, 13, 12, 19
  • 3, 7, 10, 15, 13, 15, 7, 13, 12, 20
  • 3, 7, 10, 16, 13, 14, 7, 13, 12, 19
  • 3, 7, 10, 16, 13, 14, 7, 13, 12, 20
  • 3, 8, 10, 15, 13, 14, 7, 13, 12, 19
  • 3, 9, 14, 14, 17, 6, 12, 10, 18, 16
  • 3, 9, 15, 14, 16, 6, 12, 10, 18, 16
  • 4, 7, 12, 11, 14, 12, 17, 11, 18, 18
  • 4, 7, 12, 11, 14, 12, 17, 11, 19, 18
  • 5, 7, 12, 11, 13, 12, 17, 11, 18, 18
  • 6, 12, 16, 17, 4, 8, 8, 16, 12, 20
span 1 {1 1 1}