Structure 7060355

7060342 << 7060355 >> 7060356
Original COD entry Download CIF Download DOT

Citation: Ma, Qin; Tong, Tinghao; Su, Zhi (2021). Synthesis, crystal structure and theoretical calculations of two rare-earth borates with DUV cut-off edges. New Journal of Chemistry, 45, pp. 4823-4827.

Formula: B5 Gd O10 Zn

Cell parameters:

  • a = 8.5905(2) Å
  • b = 7.5936(2) Å
  • c = 9.3872(2) Å
  • α = 90°
  • β = 93.3980(10)°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

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: B20 Gd4 O40 Zn4 (B5 Gd O10 Zn)

Multiplicity: 1

Coordination sequences:

  • 3, 12, 27, 65, 104, 152, 241, 307, 414, 528
  • 3, 12, 28, 68, 105, 159, 231, 305, 408, 527
  • 3, 13, 34, 75, 112, 170, 257, 310, 459, 522
  • 3, 14, 24, 68, 111, 159, 247, 315, 419, 505
  • 3, 14, 24, 69, 97, 164, 223, 327, 412, 499
  • 3, 16, 30, 68, 115, 171, 251, 336, 423, 513
  • 3, 21, 32, 66, 105, 166, 246, 332, 390, 515
  • 4, 8, 37, 72, 112, 172, 232, 356, 408, 547
  • 4, 8, 38, 50, 106, 159, 235, 322, 434, 489
  • 4, 8, 38, 67, 111, 163, 239, 334, 425, 520
  • 4, 13, 36, 58, 121, 159, 255, 323, 400, 532
  • 4, 13, 36, 65, 102, 172, 233, 331, 405, 511
  • 4, 20, 34, 68, 95, 184, 236, 301, 417, 520
  • 4, 21, 36, 72, 121, 178, 270, 325, 424, 560
  • 4, 25, 34, 74, 115, 179, 260, 349, 423, 546
  • 8, 23, 45, 72, 132, 197, 244, 344, 451, 564
  • 12, 20, 48, 78, 131, 202, 278, 341, 449, 584
span 1 {1 1 1}