Structure 7119156

7119155 << 7119156 >> 7119157
Original COD entry Download CIF Download DOT

Citation: Wood, Peter A.; Sarjeant, Amy A.; Yakovenko, Andrey A.; Ward, Suzanna C.; Groom, Colin R. (2016). Capturing neon -- the first experimental structure of neon trapped within a metal-organic environment. Chemical Communications (Cambridge, United Kingdom), 52, pp. 10048-10051.

Formula: C8.5 H7 Cu N5 Ne0.446 O2

Cell parameters:

  • a = 28.6315(13) Å
  • b = 9.2743(5) Å
  • c = 9.2833(5) Å
  • α = 90°
  • β = 116.615(4)°
  • γ = 90°

List type: interleaving

List: 1-3D

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 3

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

Dimensionality: 3

Formula: C68 H56 Cu8 N40 O16 (C17 H14 Cu2 N10 O4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: Ne4 (Ne)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: Ne4 (Ne)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}