Structure 1553657

1553653 << 1553657 >> 1553658
Original COD entry Download CIF Download DOT

Citation: Xu, Rosalind J.; Olshansky, Jacob H.; Adler, Philip D. F.; Huang, Yongjia; Smith, Matthew D.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J. (2018). Understanding structural adaptability: a reactant informatics approach to experiment design. Molecular Systems Design & Engineering, 3, pp. 473-.

Formula: C4 H18 N2 O22 Se6 V3

Cell parameters:

  • a = 10.0027(6) Å
  • b = 10.4765(6) Å
  • c = 12.2924(7) Å
  • α = 74.478(3)°
  • β = 72.643(3)°
  • γ = 79.707(3)°

List type: noninterleaving

List: 3D

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 1

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

Dimensionality: 3

Formula: H8 O42 Se12 V6 (H4 O21 Se6 V3)

Multiplicity: 1

span 1 {1 1 1}