Structure 7124806

7124773 << 7124806 >> 7124807
Original COD entry Download CIF Download DOT

Citation: Peralta, Ricardo A.; Campos-Reales-Pineda, Alberto; Pfeiffer, Heriberto; \'Alvarez, J Raziel; Z\'arate, J Antonio; Balmaseda, Jorge; Gonz\'alez-Zamora, Eduardo; Mart\'inez, Ana; Mart\'inez-Otero, Diego; Jancik, Vojtech; Ibarra, Ilich A. (2016). CO2 capture enhancement in InOF-1 via the bottleneck effect of confined ethanol.. Chemical communications (Cambridge, England), 52, pp. 10273-10276.

Formula: C8 H4 In O5

Chemical name: InOF-1

Cell parameters:

  • a = 15.4625(7) Å
  • b = 15.4625(7) Å
  • c = 12.3370(6) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

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 1

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

Dimensionality: 3

Formula: C64 H26 In8 O34 (C32 H13 In4 O17)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 7, 5, 14, 14, 21, 28, 52
  • 1, 2, 4, 7, 5, 16, 16, 21, 28, 48
  • 1, 2, 4, 7, 5, 16, 18, 25, 30, 52
  • 1, 2, 4, 7, 7, 11, 12, 19, 31, 46
  • 1, 2, 4, 7, 7, 12, 13, 20, 32, 46
  • 1, 2, 4, 7, 7, 12, 14, 22, 32, 42
  • 1, 2, 4, 7, 7, 12, 14, 22, 34, 48
  • 1, 2, 8, 6, 10, 14, 28, 22, 38, 40
  • 2, 5, 6, 12, 12, 24, 24, 40, 42, 55
  • 2, 5, 6, 12, 12, 24, 24, 41, 40, 56
  • 2, 5, 6, 13, 14, 25, 23, 40, 42, 58
  • 2, 5, 6, 13, 14, 25, 23, 41, 42, 58
  • 2, 6, 7, 12, 12, 23, 22, 38, 40, 55
  • 2, 6, 7, 12, 12, 23, 22, 39, 40, 53
  • 2, 6, 8, 14, 13, 25, 25, 44, 41, 54
  • 2, 6, 8, 14, 13, 25, 25, 45, 40, 55
  • 3, 4, 7, 5, 14, 14, 21, 28, 52, 51
  • 3, 4, 7, 5, 16, 16, 21, 28, 48, 47
  • 3, 4, 7, 5, 16, 18, 25, 30, 52, 45
  • 3, 4, 7, 5, 16, 18, 25, 30, 52, 53
  • 3, 4, 7, 7, 11, 12, 19, 31, 46, 43
  • 3, 4, 7, 7, 12, 13, 20, 32, 46, 46
  • 3, 4, 7, 7, 12, 14, 22, 32, 42, 41
  • 3, 4, 7, 7, 12, 14, 22, 34, 48, 46
  • 3, 4, 10, 8, 14, 18, 35, 32, 45, 54
  • 3, 4, 11, 9, 14, 18, 34, 29, 43, 54
  • 3, 4, 11, 10, 16, 19, 36, 33, 47, 52
  • 3, 4, 11, 10, 16, 19, 36, 33, 49, 55
  • 3, 6, 5, 11, 11, 18, 22, 38, 44, 61
  • 3, 6, 5, 12, 12, 19, 23, 36, 42, 61
  • 3, 6, 5, 12, 13, 21, 25, 40, 41, 59
  • 3, 6, 5, 12, 13, 21, 25, 40, 46, 65
  • 3, 6, 7, 8, 9, 16, 24, 32, 39, 63
  • 3, 6, 7, 8, 9, 18, 26, 32, 35, 61
  • 3, 6, 7, 8, 9, 18, 26, 32, 45, 63
  • 3, 6, 7, 8, 9, 18, 28, 34, 43, 65
  • 3, 8, 6, 10, 14, 28, 22, 38, 40, 60
  • 4, 4, 8, 10, 21, 18, 30, 34, 55, 51
  • 5, 6, 10, 11, 22, 19, 34, 36, 54, 51
span 1 {1 1 1}