Structure 4029698

4029203 << 4029698 >> 4029742
Original COD entry Download CIF Download DOT

Citation: Shaik, Jeelani Basha; Ramkumar, Venkatachalam; Varghese, Babu; Sankararaman, Sethuraman (2013). Synthesis and structure of trans-bis(1,4-dimesityl-3-methyl-1,2,3-triazol-5-ylidene)palladium(II) dichloride and diacetate. Suzuki-Miyaura coupling of polybromoarenes with high catalytic turnover efficiencies.. Beilstein journal of organic chemistry, 9, pp. 698-704.

Formula: C46 H56 Cl2 N8 Pd

Chemical name: ?

Cell parameters:

  • a = 14.7337(4) Å
  • b = 14.7337(4) Å
  • c = 43.098(3) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: interleaving

List: 1D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 8, entity 9 of 8

Basis: (0;1;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 9, entity 10 of 8

Basis: (0;1;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 10, entity 11 of 8

Basis: (0;1;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 11, entity 12 of 8

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 12, entity 13 of 8

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 13, entity 14 of 8

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 14, entity 15 of 8

Basis: (0;1;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 15, entity 16 of 8

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 N4 (C2 N)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}