Structure 4311685

4311684 << 4311685 >> 4311686
Original COD entry Download CIF Download DOT

Citation: Navid Soheilnia; Katja M. Kleinke; Enkhtsetseg Dashjav; Heather L. Cuthbert; John E. Greedan; Holger Kleinke (2004). Crystal Structure and Physical Properties of a New CuTi2S4 Modification in Comparison to the Thiospinel. Inorganic Chemistry, 43, pp. 6473-6478.

Formula: Cu S4 Ti2

Chemical name: ?

Cell parameters:

  • a = 7.0242(4) Å
  • b = 7.0242(4) Å
  • c = 34.834(4) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

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: Cu12 S48 Ti24 (Cu S4 Ti2)

Multiplicity: 1

Coordination sequences:

  • 4, 12, 40, 44, 120, 147, 215, 256, 345, 470
  • 4, 16, 25, 75, 85, 151, 201, 274, 335, 391
  • 4, 16, 29, 68, 84, 142, 174, 276, 308, 445
  • 4, 17, 27, 68, 90, 163, 200, 269, 359, 415
  • 4, 21, 29, 55, 90, 145, 178, 262, 370, 427
  • 6, 12, 38, 50, 108, 140, 218, 294, 354, 438
  • 6, 18, 48, 56, 104, 144, 206, 224, 414, 426
  • 7, 13, 39, 59, 107, 129, 213, 279, 329, 440
  • 7, 16, 37, 67, 96, 135, 197, 277, 357, 422
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