Structure 1569995

1569994 << 1569995 >> 1569996
Original COD entry Download CIF Download DOT

Citation: Mitchell, Travis B.; Zhang, Xiaotong; Jerozal, Ronald T.; Chen, Yu Sheng; Wang, SuYin; Benedict, Jason B. (2023). Development of a scalar-based geometric parameterization approach for the crystal structure landscape of dithienylethene-based crystalline solids.. IUCrJ, 10, pp. -.

Formula: C68 H56 N4 Ni O2 S4

Cell parameters:

  • a = 9.8621(6) Å
  • b = 21.6164(13) Å
  • c = 67.069(4) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 2D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: C136 H120 N8 Ni2 O4 S8 (C68 H60 N4 Ni O2 S4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: C136 H120 N8 Ni2 O4 S8 (C68 H60 N4 Ni O2 S4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: C136 H120 N8 Ni2 O4 S8 (C68 H60 N4 Ni O2 S4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: C136 H120 N8 Ni2 O4 S8 (C68 H60 N4 Ni O2 S4)

Multiplicity: 1

span 1 {1 1 1}