Structure 4303754

4303753 << 4303754 >> 4303770
Original COD entry Download CIF Download DOT

Citation: Sarah J. Choyke; Samuel M. Blau; Abigail A. Larner; Amy Narducci Sarjeant; Jeongho Yeon; P. Shiv Halasyamani; Alexander J. Norquist (2009). Noncentrosymmetry in New Templated Gallium Fluorophosphates. Inorganic Chemistry, 48, pp. 11277-11282.

Formula: C10 H28 F Ga3 N4 O21.5 P4

Cell parameters:

  • a = 13.0887(2) Å
  • b = 13.0887(2) Å
  • c = 29.8439(4) Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: interleaving

List: 2D

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 3

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

Dimensionality: 2

Formula: F Ga6 O32 P8 (F Ga6 O32 P8)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 15, 6, 17, 12, 33
  • 1, 3, 3, 9, 7, 19, 7, 18, 12, 32
  • 1, 3, 3, 9, 7, 19, 7, 19, 12, 32
  • 1, 3, 3, 10, 6, 15, 6, 15, 12, 33
  • 1, 3, 3, 10, 7, 19, 7, 16, 12, 32
  • 1, 4, 4, 12, 5, 12, 9, 24, 9, 21
  • 2, 6, 5, 13, 6, 16, 9, 25, 12, 30
  • 2, 6, 5, 13, 6, 16, 9, 25, 12, 31
  • 2, 6, 5, 13, 7, 19, 9, 24, 12, 32
  • 2, 6, 5, 13, 7, 19, 9, 25, 12, 31
  • 2, 6, 5, 14, 6, 15, 9, 24, 12, 32
  • 2, 6, 5, 14, 7, 18, 9, 23, 12, 32
  • 2, 6, 5, 14, 7, 18, 9, 23, 12, 33
  • 2, 6, 5, 14, 7, 18, 9, 24, 12, 30
  • 2, 6, 5, 14, 7, 18, 9, 24, 12, 31
  • 2, 6, 5, 14, 7, 18, 9, 25, 12, 30
  • 2, 6, 5, 14, 7, 19, 9, 23, 12, 32
  • 2, 6, 5, 14, 7, 19, 9, 24, 12, 31
  • 2, 6, 5, 15, 7, 17, 9, 23, 12, 32
  • 2, 6, 5, 15, 7, 18, 9, 22, 12, 32
  • 2, 6, 5, 15, 7, 18, 9, 22, 12, 33
  • 2, 7, 5, 13, 6, 15, 9, 24, 12, 30
  • 2, 7, 5, 13, 7, 18, 9, 23, 12, 31
  • 2, 7, 5, 14, 7, 17, 9, 23, 12, 30
  • 2, 7, 5, 14, 7, 18, 9, 22, 12, 31
  • 4, 3, 9, 6, 15, 6, 17, 12, 33, 12
  • 4, 3, 9, 7, 19, 7, 18, 12, 32, 12
  • 4, 3, 9, 7, 19, 7, 19, 12, 32, 12
  • 4, 3, 10, 6, 15, 6, 15, 12, 33, 12
  • 4, 3, 10, 7, 19, 7, 16, 12, 32, 12
  • 4, 4, 12, 5, 13, 9, 24, 9, 22, 16
  • 4, 4, 12, 5, 13, 9, 24, 9, 23, 16
  • 5, 4, 12, 5, 12, 9, 24, 9, 21, 16
span 1 {1 1 1}

CIF datablock 1, entity 2 of 3

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

Dimensionality: 2

Formula: F Ga6 O32 P8 (F Ga6 O32 P8)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 15, 6, 17, 12, 33
  • 1, 3, 3, 9, 7, 19, 7, 18, 12, 32
  • 1, 3, 3, 9, 7, 19, 7, 19, 12, 32
  • 1, 3, 3, 10, 6, 15, 6, 15, 12, 33
  • 1, 3, 3, 10, 7, 19, 7, 16, 12, 32
  • 1, 4, 4, 12, 5, 12, 9, 24, 9, 21
  • 2, 6, 5, 13, 6, 16, 9, 25, 12, 30
  • 2, 6, 5, 13, 6, 16, 9, 25, 12, 31
  • 2, 6, 5, 13, 7, 19, 9, 24, 12, 32
  • 2, 6, 5, 13, 7, 19, 9, 25, 12, 31
  • 2, 6, 5, 14, 6, 15, 9, 24, 12, 32
  • 2, 6, 5, 14, 7, 18, 9, 23, 12, 32
  • 2, 6, 5, 14, 7, 18, 9, 23, 12, 33
  • 2, 6, 5, 14, 7, 18, 9, 24, 12, 30
  • 2, 6, 5, 14, 7, 18, 9, 24, 12, 31
  • 2, 6, 5, 14, 7, 18, 9, 25, 12, 30
  • 2, 6, 5, 14, 7, 19, 9, 23, 12, 32
  • 2, 6, 5, 14, 7, 19, 9, 24, 12, 31
  • 2, 6, 5, 15, 7, 17, 9, 23, 12, 32
  • 2, 6, 5, 15, 7, 18, 9, 22, 12, 32
  • 2, 6, 5, 15, 7, 18, 9, 22, 12, 33
  • 2, 7, 5, 13, 6, 15, 9, 24, 12, 30
  • 2, 7, 5, 13, 7, 18, 9, 23, 12, 31
  • 2, 7, 5, 14, 7, 17, 9, 23, 12, 30
  • 2, 7, 5, 14, 7, 18, 9, 22, 12, 31
  • 4, 3, 9, 6, 15, 6, 17, 12, 33, 12
  • 4, 3, 9, 7, 19, 7, 18, 12, 32, 12
  • 4, 3, 9, 7, 19, 7, 19, 12, 32, 12
  • 4, 3, 10, 6, 15, 6, 15, 12, 33, 12
  • 4, 3, 10, 7, 19, 7, 16, 12, 32, 12
  • 4, 4, 12, 5, 13, 9, 24, 9, 22, 16
  • 4, 4, 12, 5, 13, 9, 24, 9, 23, 16
  • 5, 4, 12, 5, 12, 9, 24, 9, 21, 16
span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

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

Dimensionality: 2

Formula: F Ga6 O32 P8 (F Ga6 O32 P8)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 6, 15, 6, 17, 12, 33
  • 1, 3, 3, 9, 7, 19, 7, 18, 12, 32
  • 1, 3, 3, 9, 7, 19, 7, 19, 12, 32
  • 1, 3, 3, 10, 6, 15, 6, 15, 12, 33
  • 1, 3, 3, 10, 7, 19, 7, 16, 12, 32
  • 1, 4, 4, 12, 5, 12, 9, 24, 9, 21
  • 2, 6, 5, 13, 6, 16, 9, 25, 12, 30
  • 2, 6, 5, 13, 6, 16, 9, 25, 12, 31
  • 2, 6, 5, 13, 7, 19, 9, 24, 12, 32
  • 2, 6, 5, 13, 7, 19, 9, 25, 12, 31
  • 2, 6, 5, 14, 6, 15, 9, 24, 12, 32
  • 2, 6, 5, 14, 7, 18, 9, 23, 12, 32
  • 2, 6, 5, 14, 7, 18, 9, 23, 12, 33
  • 2, 6, 5, 14, 7, 18, 9, 24, 12, 30
  • 2, 6, 5, 14, 7, 18, 9, 24, 12, 31
  • 2, 6, 5, 14, 7, 18, 9, 25, 12, 30
  • 2, 6, 5, 14, 7, 19, 9, 23, 12, 32
  • 2, 6, 5, 14, 7, 19, 9, 24, 12, 31
  • 2, 6, 5, 15, 7, 17, 9, 23, 12, 32
  • 2, 6, 5, 15, 7, 18, 9, 22, 12, 32
  • 2, 6, 5, 15, 7, 18, 9, 22, 12, 33
  • 2, 7, 5, 13, 6, 15, 9, 24, 12, 30
  • 2, 7, 5, 13, 7, 18, 9, 23, 12, 31
  • 2, 7, 5, 14, 7, 17, 9, 23, 12, 30
  • 2, 7, 5, 14, 7, 18, 9, 22, 12, 31
  • 4, 3, 9, 6, 15, 6, 17, 12, 33, 12
  • 4, 3, 9, 7, 19, 7, 18, 12, 32, 12
  • 4, 3, 9, 7, 19, 7, 19, 12, 32, 12
  • 4, 3, 10, 6, 15, 6, 15, 12, 33, 12
  • 4, 3, 10, 7, 19, 7, 16, 12, 32, 12
  • 4, 4, 12, 5, 13, 9, 24, 9, 22, 16
  • 4, 4, 12, 5, 13, 9, 24, 9, 23, 16
  • 5, 4, 12, 5, 12, 9, 24, 9, 21, 16
span 1 {1 1 1}