Structure 4512704

4512703 << 4512704 >> 4512709
Original COD entry Download CIF Download DOT

Citation: Hill, Matthew D.; El-Hankari, Samir; Chiacchia, Mauro; Tizzard, Graham J.; Coles, Simon J.; Bradshaw, Darren; Kitchen, Jonathan A.; Keene, Tony D. (2015). Additive Effects in the Formation of Fluorescent Zinc Metal--Organic Frameworks with 5-Hydroxyisophthalate. Crystal Growth & Design, 15, pp. 1452-.

Formula: C18 H14 N O11 Zn2

Chemical name: ?

Cell parameters:

  • a = 23.6519(17) Å
  • b = 13.0546(9) Å
  • c = 26.4620(19) Å
  • α = 90°
  • β = 115.424(3)°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

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

Dimensionality: 3

Formula: C176 H72 O96 Zn16 (C22 H9 O12 Zn2)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 8, 10, 12, 22, 29, 30, 30
  • 1, 2, 3, 9, 9, 12, 22, 28, 31, 30
  • 1, 2, 4, 3, 7, 7, 16, 9, 17, 25
  • 1, 2, 4, 6, 5, 12, 8, 16, 17, 29
  • 1, 2, 4, 7, 3, 11, 20, 18, 34, 48
  • 1, 2, 4, 7, 6, 14, 12, 18, 23, 34
  • 1, 2, 4, 7, 9, 10, 16, 23, 39, 36
  • 1, 2, 4, 7, 9, 11, 15, 22, 40, 36
  • 1, 2, 4, 9, 8, 16, 9, 17, 25, 40
  • 1, 2, 4, 9, 8, 17, 10, 18, 28, 41
  • 1, 5, 7, 9, 16, 25, 22, 19, 19, 30
  • 2, 3, 6, 7, 10, 14, 23, 25, 25, 40
  • 2, 6, 9, 11, 17, 26, 26, 22, 25, 38
  • 2, 7, 8, 11, 17, 26, 26, 21, 25, 39
  • 2, 7, 10, 15, 17, 22, 20, 22, 25, 33
  • 2, 8, 9, 15, 17, 22, 20, 22, 24, 33
  • 3, 3, 8, 10, 12, 22, 29, 30, 30, 43
  • 3, 3, 9, 9, 12, 22, 28, 31, 30, 42
  • 3, 4, 3, 7, 7, 16, 9, 17, 25, 40
  • 3, 4, 6, 5, 12, 8, 16, 17, 29, 32
  • 3, 4, 7, 3, 11, 20, 18, 34, 48, 50
  • 3, 4, 7, 6, 14, 12, 18, 23, 34, 44
  • 3, 4, 7, 9, 10, 16, 23, 39, 36, 39
  • 3, 4, 7, 9, 11, 15, 22, 40, 36, 39
  • 3, 4, 9, 8, 16, 9, 17, 25, 40, 36
  • 3, 4, 9, 8, 17, 10, 18, 28, 41, 39
  • 3, 5, 4, 9, 11, 19, 16, 23, 40, 47
  • 3, 6, 4, 9, 15, 16, 27, 36, 47, 43
  • 3, 6, 4, 10, 14, 15, 28, 36, 47, 43
  • 3, 6, 10, 9, 10, 21, 35, 24, 36, 44
  • 3, 7, 7, 13, 8, 16, 17, 29, 32, 37
  • 3, 7, 7, 14, 9, 17, 20, 30, 35, 41
  • 3, 9, 8, 11, 17, 26, 23, 27, 18, 45
  • 4, 6, 14, 9, 13, 15, 27, 24, 26, 36
  • 5, 8, 9, 16, 25, 22, 19, 20, 30, 37
  • 6, 7, 9, 16, 25, 22, 19, 19, 30, 39
span 1 {1 1 1}