Structure 7043377

7043348 << 7043377 >> 7043454
Original COD entry Download CIF Download DOT

Citation: He, Piao; Wu, Le; Wu, Jin-Ting; Yin, Xin; Gozin, Michael; Zhang, Jian-Guo (2017). Alkali and alkaline earth metal salts of tetrazolone: structurally interesting and excellently thermostable. Dalton Trans., , pp. -.

Formula: C H Cs N4 O

Chemical name: Cesium 5-oxotetrazolate

Cell parameters:

  • a = 6.9541(5) Å
  • b = 13.8119(12) Å
  • c = 4.9030(4) Å
  • α = 90°
  • β = 90°
  • 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 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C H2 N8 O (C H2 N8 O)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 6, 2, 2, 6, 10, 4, 2, 2
  • 2, 4, 8, 7, 3, 2, 4, 8, 7, 3
  • 4, 4, 3, 2, 2, 6, 10, 4, 2, 2
  • 4, 4, 3, 2, 4, 6, 5, 6, 3, 4
  • 4, 6, 3, 4, 6, 5, 6, 3, 4, 6
  • 5, 5, 2, 2, 4, 8, 7, 3, 2, 4
  • 5, 6, 2, 2, 6, 10, 4, 2, 2, 6
span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C H2 N8 O (C H2 N8 O)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 6, 2, 2, 6, 10, 4, 2, 2
  • 2, 4, 8, 7, 3, 2, 4, 8, 7, 3
  • 4, 4, 3, 2, 2, 6, 10, 4, 2, 2
  • 4, 4, 3, 2, 4, 6, 5, 6, 3, 4
  • 4, 6, 3, 4, 6, 5, 6, 3, 4, 6
  • 5, 5, 2, 2, 4, 8, 7, 3, 2, 4
  • 5, 6, 2, 2, 6, 10, 4, 2, 2, 6
span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C H2 N8 O (C H2 N8 O)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 6, 2, 2, 6, 10, 4, 2, 2
  • 2, 4, 8, 7, 3, 2, 4, 8, 7, 3
  • 4, 4, 3, 2, 2, 6, 10, 4, 2, 2
  • 4, 4, 3, 2, 4, 6, 5, 6, 3, 4
  • 4, 6, 3, 4, 6, 5, 6, 3, 4, 6
  • 5, 5, 2, 2, 4, 8, 7, 3, 2, 4
  • 5, 6, 2, 2, 6, 10, 4, 2, 2, 6
span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C H2 N8 O (C H2 N8 O)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 6, 2, 2, 6, 10, 4, 2, 2
  • 2, 4, 8, 7, 3, 2, 4, 8, 7, 3
  • 4, 4, 3, 2, 2, 6, 10, 4, 2, 2
  • 4, 4, 3, 2, 4, 6, 5, 6, 3, 4
  • 4, 6, 3, 4, 6, 5, 6, 3, 4, 6
  • 5, 5, 2, 2, 4, 8, 7, 3, 2, 4
  • 5, 6, 2, 2, 6, 10, 4, 2, 2, 6
span 1 {1 1 1}