Structure 4513603

4513601 << 4513603 >> 4513604
Original COD entry Download CIF Download DOT

Citation: Dobrzycki, Lukasz; Taraszewska, Paulina; Boese, Roland; Cyra\'nski, Micha\/l K. (2015). Pyrrolidine and Its Hydrates in the Solid State. Crystal Growth & Design, 15, pp. 4804-.

Formula: C4 H42 O18

Chemical name: Tetrahydrofurane clathrate hydrate type sII

Cell parameters:

  • a = 17.2166(11) Å
  • b = 17.2166(11) Å
  • c = 17.2166(11) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

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: H544 O136 (H4 O)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 6, 6, 12, 18, 18, 30, 36, 30
  • 2, 4, 6, 6, 12, 18, 18, 30, 36, 32
  • 2, 4, 6, 6, 12, 18, 18, 30, 38, 31
  • 2, 4, 6, 6, 12, 18, 18, 30, 38, 33
  • 2, 4, 6, 6, 12, 18, 18, 32, 39, 32
  • 4, 4, 4, 12, 12, 12, 36, 24, 24, 72
  • 4, 4, 4, 12, 12, 12, 36, 26, 25, 74
span 1 {1 1 1}