Structure 2109099

2109076 << 2109099 >> 2109100
Original COD entry Download CIF Download DOT

Citation: Yakubovich, Olga V.; Kiriukhina, Galina V.; Simonov, Sergey V.; Volkov, Anatoly S.; Dimitrova, Olga V. (2023). (Na,Li)~3~(Cl,OH)[Cu~3~OAl(PO~4~)~3~]: a first salt-inclusion aluminophosphate oxocuprate with a new type of crystal structure. Acta Crystallographica Section B, 79, pp. 24-31.

Formula: Al8 Cl7 Cu24 Li4.19 Na19.81 O105 P24

Chemical name: sodium alumonophosphate oxocuprate chloride

Cell parameters:

  • a = 13.3428(4) Å
  • b = 18.9320(5) Å
  • c = 8.9404(2) Å
  • α = 90°
  • β = 90.361(2)°
  • 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: Al8 Cl4 Cu24 O104 P24 (Al2 Cl Cu6 O26 P6)

Multiplicity: 1

Coordination sequences:

  • 2, 9, 12, 38, 57, 75, 125, 143, 255, 333
  • 2, 9, 14, 29, 30, 70, 108, 163, 262, 296
  • 2, 9, 18, 45, 52, 103, 127, 189, 260, 325
  • 2, 10, 14, 38, 46, 69, 111, 163, 247, 309
  • 2, 10, 18, 41, 57, 87, 141, 197, 265, 388
  • 2, 10, 19, 48, 60, 94, 131, 195, 268, 336
  • 2, 10, 22, 58, 85, 113, 153, 228, 301, 398
  • 2, 12, 13, 32, 50, 62, 101, 122, 246, 312
  • 3, 14, 19, 37, 47, 78, 125, 174, 276, 339
  • 3, 15, 19, 36, 49, 70, 125, 193, 266, 337
  • 3, 16, 23, 50, 73, 112, 161, 215, 285, 372
  • 3, 16, 23, 52, 79, 112, 169, 212, 287, 370
  • 3, 17, 31, 54, 66, 107, 168, 231, 290, 350
  • 3, 17, 31, 56, 66, 104, 168, 229, 292, 360
  • 4, 6, 32, 41, 56, 84, 129, 201, 274, 343
  • 4, 6, 35, 52, 79, 118, 159, 220, 332, 394
  • 4, 15, 15, 32, 38, 76, 117, 186, 272, 319
  • 5, 9, 29, 43, 63, 107, 136, 202, 274, 383
  • 6, 6, 26, 38, 58, 88, 88, 210, 254, 328
  • 8, 11, 24, 35, 52, 85, 120, 201, 264, 336
  • 8, 14, 22, 31, 54, 92, 140, 225, 287, 354
  • 8, 18, 35, 55, 94, 122, 181, 248, 309, 382
  • 10, 16, 22, 40, 50, 82, 164, 216, 312, 344
  • 10, 24, 38, 56, 94, 136, 194, 252, 310, 382
  • 10, 24, 38, 56, 94, 138, 190, 250, 310, 388
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