Structure 9011114

9011113 << 9011114 >> 9011115
Original COD entry Download CIF Download DOT

Citation: Thewalt, U.; Bugg, C. E.; Marsh, R. E. (1971). The crystal structure of guanine monohydrate. Acta Crystallographica, Section B, 27, pp. 2358-2362.

Formula: C5 H7 N5 O2

Cell parameters:

  • a = 16.510 Å
  • b = 11.277 Å
  • c = 3.645 Å
  • α = 90°
  • β = 96.8°
  • γ = 90°

List type: interleaving

List: 1D

Combined 3D structure and graph

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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: H6 O2 (H3 O)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 2, 4, 2, 2, 4, 2, 2
  • 2, 3, 3, 2, 3, 3, 2, 3, 3, 2
  • 3, 2, 2, 4, 2, 2, 4, 2, 2, 4
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CIF datablock 5, entity 6 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: H6 O2 (H3 O)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 2, 4, 2, 2, 4, 2, 2
  • 2, 3, 3, 2, 3, 3, 2, 3, 3, 2
  • 3, 2, 2, 4, 2, 2, 4, 2, 2, 4
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