Structure 4504743

4504742 << 4504743 >> 4504745
Original COD entry Download CIF Download DOT

Citation: Custelcean, Radu; Moyer, Bruce A.; Bryantsev, Vyacheslav S.; Hay, Benjamin P. (2006). Anion Coordination in Metal−Organic Frameworks Functionalized with Urea Hydrogen-Bonding Groups. Crystal Growth & Design, 6, pp. 555-.

Formula: C22 H20 Cl2 N8 O10 Zn

Chemical name: ?

Cell parameters:

  • a = 16.9462(15) Å
  • b = 16.9462(15) Å
  • c = 18.477(3) Å
  • α = 90.00°
  • β = 90.00°
  • 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 4

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

Dimensionality: 2

Formula: C44 H40 N16 O4 Zn2 (C22 H20 N8 O2 Zn)

Multiplicity: 1

Coordination sequences:

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

CIF datablock 1, entity 2 of 4

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

Dimensionality: 2

Formula: C44 H40 N16 O4 Zn2 (C22 H20 N8 O2 Zn)

Multiplicity: 1

Coordination sequences:

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

CIF datablock 2, entity 3 of 4

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

Dimensionality: 2

Formula: C44 H40 N16 O4 Zn2 (C22 H20 N8 O2 Zn)

Multiplicity: 1

Coordination sequences:

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

CIF datablock 3, entity 4 of 4

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

Dimensionality: 2

Formula: C44 H40 N16 O4 Zn2 (C22 H20 N8 O2 Zn)

Multiplicity: 1

Coordination sequences:

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