Structure 4002317

4002316 << 4002317 >> 4002318
Original COD entry Download CIF Download DOT

Citation: Liu, Y.-L.; Shi, Z.; Zhang, L.-R.; Hua, J.; Chen, J.-S.; Li, B.-Z.; Fu, Y.-L.; Pang, W.-Q. (2001). Hydrothermal synthesis and characterization of two three-dimensional titanium phosphates. Chemistry of Materials (1,1989-), 13, pp. 2017-2022.

Formula: C6 H20 N2 O48 P12 Ti7

Chemical name: (Ti7 (H P O4)6 (P O4)6) (C6 N2 H14)

Cell parameters:

  • a = 16.864 Å
  • b = 16.864 Å
  • c = 12.334 Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: O144 P36 Ti21 (O48 P12 Ti7)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 15, 13, 37, 17, 71, 49, 125
  • 2, 8, 7, 23, 15, 51, 32, 98, 50, 157
  • 2, 8, 7, 24, 15, 51, 32, 97, 50, 154
  • 2, 8, 7, 24, 15, 52, 32, 95, 50, 161
  • 2, 8, 8, 27, 16, 51, 33, 109, 56, 163
  • 2, 8, 8, 27, 16, 53, 33, 104, 56, 166
  • 2, 8, 8, 28, 16, 52, 33, 107, 56, 163
  • 2, 8, 8, 28, 19, 64, 36, 104, 50, 154
  • 4, 3, 15, 13, 37, 17, 71, 49, 125, 49
  • 4, 4, 20, 15, 40, 19, 81, 56, 143, 49
  • 6, 6, 18, 9, 39, 30, 81, 33, 130, 84
  • 6, 6, 18, 12, 54, 36, 90, 30, 114, 84
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