Structure 1560399

1560398 << 1560399 >> 1560400
Original COD entry Download CIF Download DOT

Citation: Choudhury, Amitava; Mohapatra, Sudip; Yaghoobnejad Asl, Hooman; Lee, Seng Huat; Hor, Yew San; Medvedeva, Julia E.; McClane, Devon L.; Hilmas, Gregory E.; McGuire, Michael A.; May, Andrew F.; Wang, Hsin; Dash, Shreeram; Welton, Aaron; Boolchand, Punit; Devlin, Kasey P.; Aitken, Jennifer; Herbst-Irmer, Regine; Pet\

Formula: Cu4 S4 Sn

Cell parameters:

  • a = 10.058(6) Å
  • b = 13.489(8) Å
  • c = 10.085(6) Å
  • α = 90.00°
  • β = 100.840(7)°
  • γ = 90.00°

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: Cu32 S32 Sn8 (Cu4 S4 Sn)

Multiplicity: 1

Coordination sequences:

  • 4, 14, 41, 62, 118, 176, 251, 345, 436, 548
  • 4, 14, 45, 77, 128, 180, 260, 348, 469, 582
  • 4, 16, 35, 75, 110, 178, 259, 332, 442, 552
  • 4, 18, 37, 77, 121, 192, 262, 354, 462, 570
  • 4, 18, 39, 77, 121, 186, 264, 348, 452, 577
  • 4, 18, 39, 82, 124, 184, 261, 356, 465, 583
  • 5, 17, 33, 70, 105, 174, 241, 325, 431, 540
  • 5, 18, 35, 73, 116, 184, 260, 352, 437, 562
  • 5, 18, 41, 78, 128, 191, 260, 364, 466, 576
  • 5, 20, 42, 84, 128, 191, 264, 366, 475, 587
  • 6, 16, 40, 70, 120, 184, 260, 348, 443, 554
  • 6, 19, 48, 78, 134, 194, 266, 365, 473, 590
  • 7, 18, 42, 74, 125, 191, 274, 353, 455, 575
  • 7, 18, 44, 77, 131, 192, 278, 359, 455, 589
  • 7, 21, 44, 83, 137, 198, 276, 364, 459, 588
  • 7, 22, 47, 84, 143, 201, 275, 382, 479, 595
  • 7, 23, 49, 91, 143, 204, 287, 386, 494, 614
  • 8, 23, 53, 92, 141, 208, 288, 380, 498, 612
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