Structure 2020529

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Citation: G\"orbitz, Carl Henrik; Wragg, David S.; Bakke, Ingrid Marie Bergh; Fleischer, Christian; Gr\/onnevik, Gaute; Mykland, Maria; Park, Yoomin; Trovik, Kristian Wiedicke; Serigstad, Halvard; Sundsli, B\%ard Edgar Vestheim (2016). A phase transition from monoclinic C2 with Z' = 1 to triclinic P1 with Z' = 4 for the quasiracemate L-2-aminobutyric acid--D-methionine (1/1). Acta Crystallographica Section C, 72, pp. 536-543.

Formula: C9 H20 N2 O4 S

Chemical name: (<i>S</i>)-2-aminobutanoic acid--(<i>R</i>)-2-amino-4-(methylsulfanyl)butanoic acid (1/1)

Cell parameters:

  • a = 29.1721(18) Å
  • b = 4.7784(3) Å
  • c = 9.8551(6) Å
  • α = 90°
  • β = 103.145(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 0, entity 1 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C33 H70 N2 O4 S8 (C33 H70 N2 O4 S8)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C33 H70 N2 O4 S8 (C33 H70 N2 O4 S8)

Multiplicity: 1

span 1 {1 1 1}