Structure 7247192

7247191 << 7247192 >> 7247193
Original COD entry Download CIF Download DOT

Citation: Habib, Faiza; Tocher, Derek A.; Carmalt, Claire J. (2023). Encapsulation of N-containing compounds in a new hydrophilic Cd-based crystalline sponge via coordinative alignment method. CrystEngComm, 25, pp. 5001-5011.

Formula: C123 H108.67 Cd4.67 N15 O27.67

Chemical name: xstr1393

Cell parameters:

  • a = 14.75582(16) Å
  • b = 42.9510(3) Å
  • c = 33.8388(3) Å
  • α = 90°
  • β = 93.4415(9)°
  • γ = 90°

List type: interleaving

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 2

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

Dimensionality: 3

Formula: C388 H336 Cd14 N44 O82 (C194 H168 Cd7 N22 O41)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 3

Formula: C388 H336 Cd14 N44 O82 (C194 H168 Cd7 N22 O41)

Multiplicity: 1

span 1 {1 1 1}