Structure 4132974

4132965 << 4132974 >> 4132978
Original COD entry Download CIF Download DOT

Citation: Hwang, Jungwun; Li, Ping; Smith, Mark D.; Warden, Constance E.; Sirianni, Dominic A.; Vik, Erik C.; Maier, Josef M.; Yehl, Christopher J.; Sherrill, C. David; Shimizu, Ken D. (2018). Tipping the Balance between S-\p and O-\p Interactions.. Journal of the American Chemical Society, 140, pp. 13301-13307.

Formula: C44.81 H30.81 Cl5.44 N O5

Cell parameters:

  • a = 15.8387(8) Å
  • b = 24.1540(12) Å
  • c = 10.6840(5) Å
  • α = 90°
  • β = 102.962(2)°
  • γ = 90°

List type: interleaving

List: 1D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 4, entity 5 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C4 H4 Cl12 (C H Cl3)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 5, entity 6 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C4 H4 Cl12 (C H Cl3)

Multiplicity: 1

span 1 {1 1 1}