Structure 7036368

7036337 << 7036368 >> 7036378
Original COD entry Download CIF Download DOT

Citation: Steciuk, I.; Durka, K.; Gontarczyk, K.; D\; abrowski, M; Luli\'nski, S; Wo\'zniak, K (2015). Nitrogen-boron coordination versus OHN hydrogen bonding in pyridoxaboroles - aza analogues of benzoxaboroles.. Dalton transactions (Cambridge, England : 2003), 44, pp. 16534-16546.

Formula: C15 H16 B N O2

Chemical name: Pyridino[4,3-c]-1,3-dihydro-1-hydroxy-3-mezytyl[2,1]oxaborole

Cell parameters:

  • a = 12.9283(4) Å
  • b = 10.0001(2) Å
  • c = 20.1811(7) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 1D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C30 H32 B2 N2 O4 (C15 H16 B N O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C30 H32 B2 N2 O4 (C15 H16 B N O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C30 H32 B2 N2 O4 (C15 H16 B N O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (0;1;0)

Dimensionality: 1

Formula: C30 H32 B2 N2 O4 (C15 H16 B N O2)

Multiplicity: 1

span 1 {1 1 1}