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: C74 H66 Br2 Cu N6 O2 S4
Cell parameters:
a = 9.5108(3) Å
b = 11.4444(3) Å
c = 16.0164(4) Å
α = 105.0120(10)°
β = 98.4520(10)°
γ = 99.1780(10)°
List type: noninterleaving
List: 1D
Combined 3D structure and graph
span 1{1 1 1}
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Linear Graph Knot
Molecules
CIF datablock 0, entity 1 of 1
Basis: (0;1;0)
Dimensionality: 1
Formula: C68 H52 Br2 Cu N4 S4 (C68 H52 Br2 Cu N4 S4)