Structure 4003629

4003614 << 4003629 >> 4003635
Original COD entry Download CIF Download DOT

Citation: Chung, Jee Yoon; Jo, Hongil; Yeon, Seongbeom; Byun, Hye Ryung; You, Tae-Soo; Jang, Joon I.; Ok, Kang Min (2020). Bi3(SeO3)3(Se2O5)F: A Polar Bismuth Selenite Fluoride with Polyhedra of Highly Distortive Lone Pair Cations and Strong Second-Harmonic Generation Response. Chemistry of Materials, , pp. -.

Formula: Bi3 F O14 Se5

Cell parameters:

  • a = 6.8852(5) Å
  • b = 7.2600(5) Å
  • c = 14.7694(9) Å
  • α = 90°
  • β = 97.2854(19)°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

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

Dimensionality: 3

Formula: Bi6 F2 O28 Se10 (Bi3 F O14 Se5)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 6, 15, 15, 41, 36, 88, 64, 141
  • 2, 4, 4, 19, 17, 32, 34, 113, 92, 169
  • 2, 6, 6, 17, 19, 48, 40, 99, 69, 144
  • 2, 6, 7, 19, 18, 47, 43, 105, 76, 171
  • 2, 6, 7, 19, 21, 59, 46, 99, 68, 159
  • 2, 6, 8, 22, 21, 60, 44, 94, 70, 165
  • 2, 6, 9, 28, 25, 59, 44, 110, 79, 160
  • 2, 7, 7, 15, 16, 55, 48, 94, 67, 182
  • 2, 7, 7, 17, 17, 53, 50, 108, 78, 187
  • 2, 7, 7, 17, 17, 54, 52, 113, 79, 189
  • 2, 7, 8, 21, 25, 66, 47, 110, 80, 182
  • 2, 7, 8, 23, 22, 57, 49, 111, 78, 180
  • 2, 7, 8, 23, 23, 58, 49, 111, 80, 187
  • 3, 3, 11, 11, 28, 28, 74, 61, 147, 106
  • 3, 3, 11, 14, 33, 29, 83, 59, 119, 85
  • 3, 3, 12, 12, 26, 25, 82, 76, 150, 91
  • 3, 4, 17, 19, 40, 32, 94, 70, 131, 92
  • 3, 4, 18, 18, 36, 30, 91, 72, 136, 92
  • 3, 10, 10, 29, 26, 61, 49, 118, 83, 176
  • 3, 10, 11, 28, 25, 68, 50, 105, 79, 184
  • 5, 6, 15, 15, 41, 36, 88, 64, 141, 101
  • 5, 7, 17, 17, 54, 41, 81, 60, 152, 106
  • 6, 6, 12, 14, 49, 45, 88, 60, 166, 129
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