Structure 7208876

7208875 << 7208876 >> 7208877
Original COD entry Download CIF Download DOT

Citation: Williams, Edward R.; Weller, Mark T. (2013). Hydrothermal synthesis and structural characterisation of [H2DABCO]3[Cu16Cl22]: a new copper(i) chloride framework. CrystEngComm, 15, pp. 31-.

Formula: C18 H42 Cl22 Cu16 N6

Cell parameters:

  • a = 12.8722(5) Å
  • b = 12.9237(4) Å
  • c = 29.641(2) Å
  • α = 90.00°
  • β = 90.00°
  • 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: Cl88 Cu76 (Cl22 Cu19)

Multiplicity: 1

Coordination sequences:

  • 2, 7, 16, 32, 51, 101, 142, 184, 248, 341
  • 2, 8, 16, 34, 49, 99, 146, 179, 251, 346
  • 2, 9, 16, 35, 47, 93, 133, 192, 248, 328
  • 2, 11, 18, 32, 66, 104, 152, 194, 263, 326
  • 2, 11, 19, 41, 64, 94, 141, 189, 280, 333
  • 3, 12, 16, 40, 66, 105, 155, 207, 279, 351
  • 3, 12, 17, 39, 68, 99, 163, 205, 277, 350
  • 3, 12, 19, 38, 58, 110, 142, 200, 271, 346
  • 3, 12, 22, 35, 61, 102, 137, 190, 257, 349
  • 3, 12, 22, 37, 72, 115, 153, 209, 278, 366
  • 3, 12, 25, 36, 59, 107, 157, 203, 267, 343
  • 3, 13, 16, 39, 60, 98, 148, 211, 254, 333
  • 3, 13, 21, 35, 73, 113, 154, 220, 272, 367
  • 3, 13, 24, 40, 70, 112, 160, 221, 291, 339
  • 3, 13, 24, 43, 68, 119, 160, 238, 276, 349
  • 3, 14, 17, 35, 64, 101, 148, 190, 286, 336
  • 3, 14, 25, 38, 66, 108, 158, 206, 278, 364
  • 3, 15, 19, 32, 71, 109, 152, 221, 270, 340
  • 4, 15, 19, 41, 74, 102, 147, 208, 285, 346
  • 4, 18, 21, 33, 68, 115, 149, 207, 275, 358
  • 5, 10, 25, 39, 74, 117, 165, 223, 297, 348
  • 5, 10, 26, 37, 70, 119, 162, 222, 289, 359
  • 5, 14, 20, 44, 60, 97, 151, 205, 279, 334
  • 5, 14, 21, 38, 82, 118, 162, 211, 302, 372
  • 5, 16, 21, 47, 71, 113, 152, 219, 295, 357
  • 6, 12, 26, 37, 64, 107, 162, 204, 282, 361
  • 6, 14, 23, 36, 84, 119, 157, 224, 305, 376
  • 7, 13, 26, 47, 79, 118, 180, 235, 288, 362
  • 7, 14, 28, 47, 81, 119, 180, 232, 302, 373
  • 7, 15, 27, 49, 77, 124, 161, 243, 307, 371
  • 7, 15, 30, 47, 81, 128, 174, 237, 304, 373
  • 7, 20, 25, 44, 83, 129, 166, 222, 311, 382
  • 8, 15, 25, 52, 81, 122, 180, 236, 299, 363
  • 8, 15, 26, 53, 88, 138, 175, 244, 307, 398
  • 8, 16, 24, 53, 87, 135, 184, 235, 313, 388
  • 9, 15, 26, 49, 80, 114, 162, 225, 307, 360
  • 9, 15, 28, 48, 78, 114, 170, 233, 304, 366
  • 10, 12, 26, 50, 78, 120, 162, 237, 300, 369
  • 10, 15, 26, 54, 76, 123, 165, 244, 310, 371
  • 10, 15, 29, 46, 84, 120, 168, 237, 309, 373
  • 11, 17, 32, 56, 91, 122, 179, 242, 328, 371
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