Structure 7061291

7061289 << 7061291 >> 7061323
Original COD entry Download CIF Download DOT

Citation: Sharma, Pranay; Baishya, Trishnajyoti; Gomila, Rosa M.; Frontera, Antonio; Barcelo-Oliver, Miquel; Verma, Akalesh K.; Das, Jumi; Bhattacharyya, Manjit K. (2022). Structural topologies involving energetically significant antiparallel \p-stacking and unconventional N(nitrile)⋯\p(fumarate) contacts in dinuclear Zn(ii) and polymeric Mn(ii) compounds: antiproliferative evaluation and theoretical studies. New Journal of Chemistry, 46, pp. 5296-5311.

Formula: C16 H14 Mn N4 O6

Cell parameters:

  • a = 8.1469(2) Å
  • b = 9.2011(3) Å
  • c = 12.4602(4) Å
  • α = 91.8260(10)°
  • β = 94.3030(10)°
  • γ = 104.4420(10)°

List type: interleaving

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 2

Basis: (0;1;0)

Dimensionality: 1

Formula: C16 H14 Mn N4 O6 (C16 H14 Mn N4 O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;1;0)

Dimensionality: 1

Formula: C16 H14 Mn N4 O6 (C16 H14 Mn N4 O6)

Multiplicity: 1

span 1 {1 1 1}