Structure 7109944

7109904 << 7109944 >> 7109945
Original COD entry Download CIF Download DOT

Citation: Anatolie Dobrov; Simone Goschl; Michael A. Jakupec; Ana Popovic-Bijelic; Astrid Graslund; Peter Raptad; Vladimir B. Arion (2013). A highly cytotoxic modified paullone ligand bearing a TEMPO free-radical unit and its copper(II) complex as potential hR2 RNR inhibitors. Chem.Commun., 49, pp. 10007-.

Formula: C66 H70 Cl2 Cu2 N14 O4

Chemical name: N-(9-Carboxamide)-N-(4-amino-2,2,6,6-tetramethylpiperidinooxy)-7,12-dihydroindolo-[3,2-d][1]benzazepin-6(5H)-ylidene)-N'-(1-pyridin-2-yl-ethyliden]azin-5-ide-chlorido-copper(II) tetrahydrofurane solvate

Cell parameters:

  • a = 12.7891(7) Å
  • b = 28.6933(15) Å
  • c = 11.9318(6) Å
  • α = 90.00°
  • β = 104.934(3)°
  • γ = 90.00°

List type: interleaving

List: 1D

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: (0;0;1)

Dimensionality: 1

Formula: C33 H35 Cl Cu N7 O2 (C33 H35 Cl Cu N7 O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C33 H35 Cl Cu N7 O2 (C33 H35 Cl Cu N7 O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C33 H35 Cl Cu N7 O2 (C33 H35 Cl Cu N7 O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (0;0;1)

Dimensionality: 1

Formula: C33 H35 Cl Cu N7 O2 (C33 H35 Cl Cu N7 O2)

Multiplicity: 1

span 1 {1 1 1}