Structure 4310721

4310713 << 4310721 >> 4310724
Original COD entry Download CIF Download DOT

Citation: Jos\'e S. Casas; Eduardo E. Castellano; Mar\'ia D. Couce; Javier Ellena; Agust\'in S\'anchez; Jos\'e L. S\'anchez; Jos\'e Sordo; Carmen Taboada (2004). The Reaction of Dimethyltin(IV) Dichloride with Thiamine Diphosphate (H2TDP): Synthesis and Structure of [SnMe2(HTDP)(H2O)]Cl.H2O, and Possibility of a Hitherto Unsuspected Role of the Metal Cofactor in the Mechanism of Vitamin-B1-Dependent Enzymes. Inorganic Chemistry, 43, pp. 1957-1963.

Formula: C14 H27 Cl N4 O9 P2 S Sn

Cell parameters:

  • a = 22.2209(4) Å
  • b = 8.8241(2) Å
  • c = 24.1119(6) Å
  • α = 90.00°
  • β = 90.00°
  • 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;1;0)

Dimensionality: 1

Formula: C28 H46 N8 O14 P4 S2 Sn2 (C14 H23 N4 O7 P2 S Sn)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C28 H46 N8 O14 P4 S2 Sn2 (C14 H23 N4 O7 P2 S Sn)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C28 H46 N8 O14 P4 S2 Sn2 (C14 H23 N4 O7 P2 S Sn)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C28 H46 N8 O14 P4 S2 Sn2 (C14 H23 N4 O7 P2 S Sn)

Multiplicity: 1

span 1 {1 1 1}