Structure 7159893

7159705 << 7159893 >> 7200143
Original COD entry Download CIF Download DOT

Citation: Gerasimova, Tatiana; Zagidullin, Almaz; Nikolaeva, Anastasiya; Fayzullin, Robert R.; Saitova, Alya; Miluykov, Vasily; Grimme, Stefan; Katsyuba, Sergey (2024). Structural flexibility of favipiravir and its structural analogues in solutions: experimental and computational insight. Organic & Biomolecular Chemistry, , pp. -.

Formula: C5 H6.18 N3 O2.59

Cell parameters:

  • a = 3.62939(6) Å
  • b = 17.4327(3) Å
  • c = 10.06875(17) Å
  • α = 90°
  • β = 99.9049(16)°
  • γ = 90°

List type: interleaving

List: 1D

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Linear Graph Knot

Molecules

CIF datablock 4, entity 5 of 2

Basis: (1;0;0)

Dimensionality: 1

Formula: H8 O4 (H2 O)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 5, entity 6 of 2

Basis: (1;0;0)

Dimensionality: 1

Formula: H8 O4 (H2 O)

Multiplicity: 1

span 1 {1 1 1}