Structure 2201176

2201172 << 2201176 >> 2201186
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Citation: Angelov, Christo M.; van den Heever, Johan P.; McDonald, Robert; McEwan, Alexander J. B.; Mercer, John R.; 3-methyl-1,2-butadiene-1,1-diphosphonic acid, anilinium salt (2002). Anilinium 3-methyl-1,2-butadienyl-1,1-diphosphonate(1--). Acta Crystallographica Section E, 58, pp. o498-o500.

Formula: C11 H17 N O6 P2

Chemical name: 3-methyl-1,2-butadiene-1,1-diphosphonic acid, anilinium salt

Cell parameters:

  • a = 9.9331(14) Å
  • b = 20.188(3) Å
  • c = 14.701(2) 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: (1;0;0)

Dimensionality: 1

Formula: C10 H18 O12 P4 (C5 H9 O6 P2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C10 H18 O12 P4 (C5 H9 O6 P2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C10 H18 O12 P4 (C5 H9 O6 P2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C10 H18 O12 P4 (C5 H9 O6 P2)

Multiplicity: 1

span 1 {1 1 1}