organic compounds\(\def\hfill{\hskip 5em}\def\hfil{\hskip 3em}\def\eqno#1{\hfil {#1}}\)

Journal logoCRYSTALLOGRAPHIC
COMMUNICATIONS
ISSN: 2056-9890

Crystal structure of bis­­[(5-oxo­oxolan-3-yl)triphen­ylphosphanium] hexa­iodido­tellurate(IV)

aDepartment of Chemistry, P.O. Box 3000, FI-90014 University of Oulu, Finland
*Correspondence e-mail: risto.laitinen@oulu.fi

Edited by M. Zeller, Youngstown State University, USA (Received 26 October 2014; accepted 30 October 2014; online 5 November 2014)

The asymmetric unit of the title salt, [C22H20O2P]2+[TeI6]2−, consists of one triphenyl(5-oxooxolan-3-yl)phosphanium cation and one half of a hexa­iodido­tellurate(IV) dianion. The Te atom is located at an inversion centre and is octa­hedrally coordinated by six I atoms. The Te—I bond lengths range from 2.9255 (9) to 2.9439 (10) Å. The I—Te—I angles between cis-iodide ligands are in the range 87.85 (3)–92.15 (3)°. In the crystal, the components are connected by C—H⋯I inter­actions. In the final refinement of the compound a void of 32 Å3 was observed.

1. Related literature

For the isolation and structure of the related compound {PPh3(C4H5O2)}2[TeI4], see: Närhi et al. (2013[Närhi, S. M., Malo, K., Oilunkaniemi, R. & Laitinen, R. S. (2013). Polyhedron, 65, 308-315.]). For other related structures, see: Srivastava et al. (2004[Srivastava, P. C., Bajpai, S., Bajpai, S., Ram, C., Kumar, R., Jasinski, J. P. & Butcher, R. J. (2004). J. Organomet. Chem. 689, 194-202.]); Närhi et al. (2004[Närhi, S. M., Oilunkaniemi, R., Laitinen, R. S. & Ahlgrén, M. (2004). Inorg. Chem. 43, 3742-3750.]). For discussion about the formation of the cation, see: Närhi et al. (2013[Närhi, S. M., Malo, K., Oilunkaniemi, R. & Laitinen, R. S. (2013). Polyhedron, 65, 308-315.]).

[Scheme 1]

2. Experimental

2.1. Crystal data

  • 2C22H20O2P+·TeI62−

  • Mr = 1583.70

  • Triclinic, [P \overline 1]

  • a = 9.4479 (19) Å

  • b = 11.022 (2) Å

  • c = 13.259 (3) Å

  • α = 74.64 (3)°

  • β = 69.70 (3)°

  • γ = 77.28 (3)°

  • V = 1236.1 (5) Å3

  • Z = 1

  • Mo Kα radiation

  • μ = 4.45 mm−1

  • T = 100 K

  • 0.25 × 0.20 × 0.20 mm

2.2. Data collection

  • Bruker Nonius KappaCCD diffractometer

  • Absorption correction: ψ scan (XPREP in SHELXTL; Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]) Tmin = 0.543, Tmax = 0.927

  • 11104 measured reflections

  • 4557 independent reflections

  • 3957 reflections with I > 2σ(I)

  • Rint = 0.039

2.3. Refinement

  • R[F2 > 2σ(F2)] = 0.032

  • wR(F2) = 0.078

  • S = 1.05

  • 4557 reflections

  • 260 parameters

  • H-atom parameters constrained

  • Δρmax = 0.80 e Å−3

  • Δρmin = −1.04 e Å−3

Table 1
Hydrogen-bond geometry (Å, °)

D—H⋯A D—H H⋯A DA D—H⋯A
C35—H35⋯I1ii 0.95 3.17 4.080 (6) 161
C16—H16⋯I2 0.95 2.97 3.839 (5) 152
C22—H22⋯I2iii 0.95 3.09 3.875 (6) 141
C32—H32⋯I3iii 0.95 3.08 3.958 (6) 155
Symmetry codes: (ii) -x, -y+1, -z; (iii) x+1, y, z.

Data collection: COLLECT (Hooft, 1998[Hooft, R. W. W. (1998). COLLECT. Nonius BV, Delft, The Netherlands.]); cell refinement: DENZO-SMN (Otwinowski & Minor, 1997[Otwinowski, Z. & Minor, W. (1997). Methods in Enzymology, Vol. 276, Macromolecular Crystallography, Part A, edited by C. W. Carter Jr & R. M. Sweet, pp. 307-326. New York: Academic Press.]); data reduction: DENZO-SMN; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); program(s) used to refine structure: SHELXL2013 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); molecular graphics: DIAMOND (Brandenburg, 2006[Brandenburg, K. (2006). DIAMOND. Crystal Impact GmbH, Bonn, Germany.]); software used to prepare material for publication: WinGX (Farrugia, 2012[Farrugia, L. J. (2012). J. Appl. Cryst. 45, 849-854.]).

Supporting information


Synthesis and crystallization top

Dark purple crystals of {PPh3(C4H5O2)}2[TeI6] were isolated in the reaction of Fu2Te2 (Fu = 2-furyl, C4H5O), I2, and Ph3P in THF. Under ambient conditions, the reaction is reported to give a mixture of products (Närhi et al. (2013)). The crystals of {PPh3(C4H5O2)}2[TeI6] are probably formed by the reaction of {PPh3(C4H5O2)}2[TeI4] with I2. They are formed as a separate layer on the wall of the reaction vessel during slow evaporation of the solvent.

Refinement top

H atoms were positioned geometrically and refined using a riding model with C—H = 0.99 Å and with Uiso(H) = 1.2Ueq(C), 1.00 Å and Uiso(H) = 1.2Ueq(C) and 0.95 Å and Uiso(H) = 1.2Ueq(C) for the methyl­ene, tertiary, and aromatic hydrogens, respectively.

In the final refinement of the compound a void of 32 Å3 was observed. The void contains no residual electron density and the volume is very small for solvent molecules. The cavity probably results from the inflexible packing of the bulky, rigid ions of the title compound.

Related literature top

For the isolation and structure of the related compound {PPh3(C4H5O2)}2[TeI4], see: Närhi et al. (2013). For other related structures, see: Srivastava et al. (2004); Närhi et al. (2004). For discussion about the formation of the cation, see: Närhi et al. (2013).

Computing details top

Data collection: COLLECT (Hooft, 1998); cell refinement: DENZO-SMN (Otwinowski & Minor, 1997); data reduction: DENZO-SMN (Otwinowski & Minor, 1997); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL2013 (Sheldrick, 2008); molecular graphics: DIAMOND (Brandenburg, 2006); software used to prepare material for publication: WinGX (Farrugia, 2012).

Figures top
Fig. 1. The molecular structure of {Ph3(C4H5O2)P}2[TeI6] indicating the numbering of the atoms. The displacement ellipsoids have been drawn at 50% probability. Hydrogen atoms have been omitted for clarity. Symmetry code: i: -x, -y, -z.

Fig. 2. The shortest H···I hydrogen bonds between the cation and the anion. The van der Waals' radius of iodine has been overlaid with the structure of the anion.
Bis[(5-oxooxolan-3-yl)triphenylphosphanium] hexaiodidotellurate(IV) top
Crystal data top
2C22H20O2P+·TeI62Z = 1
Mr = 1583.70F(000) = 736
Triclinic, P1Dx = 2.128 Mg m3
a = 9.4479 (19) ÅMo Kα radiation, λ = 0.71073 Å
b = 11.022 (2) ÅCell parameters from 3957 reflections
c = 13.259 (3) Åθ = 2.8–25.7°
α = 74.64 (3)°µ = 4.45 mm1
β = 69.70 (3)°T = 100 K
γ = 77.28 (3)°Block, dark purple
V = 1236.1 (5) Å30.25 × 0.20 × 0.20 mm
Data collection top
Bruker Nonius KappaCCD
diffractometer
3957 reflections with I > 2σ(I)
Radiation source: fine-focus sealed tubeRint = 0.039
ϕ scans, and ω scans with κ offsetsθmax = 25.7°, θmin = 2.8°
Absorption correction: ψ scan
(XPREP in SHELXTL; Sheldrick, 2008)
h = 1111
Tmin = 0.543, Tmax = 0.927k = 1313
11104 measured reflectionsl = 1516
4557 independent reflections
Refinement top
Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.032H-atom parameters constrained
wR(F2) = 0.078 w = 1/[σ2(Fo2) + (0.0302P)2 + 2.1829P]
where P = (Fo2 + 2Fc2)/3
S = 1.05(Δ/σ)max = 0.001
4557 reflectionsΔρmax = 0.80 e Å3
260 parametersΔρmin = 1.03 e Å3
0 restraintsExtinction correction: SHELXL2013 (Sheldrick, 2008), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4
Primary atom site location: structure-invariant direct methodsExtinction coefficient: 0.0026 (3)
Crystal data top
2C22H20O2P+·TeI62γ = 77.28 (3)°
Mr = 1583.70V = 1236.1 (5) Å3
Triclinic, P1Z = 1
a = 9.4479 (19) ÅMo Kα radiation
b = 11.022 (2) ŵ = 4.45 mm1
c = 13.259 (3) ÅT = 100 K
α = 74.64 (3)°0.25 × 0.20 × 0.20 mm
β = 69.70 (3)°
Data collection top
Bruker Nonius KappaCCD
diffractometer
4557 independent reflections
Absorption correction: ψ scan
(XPREP in SHELXTL; Sheldrick, 2008)
3957 reflections with I > 2σ(I)
Tmin = 0.543, Tmax = 0.927Rint = 0.039
11104 measured reflections
Refinement top
R[F2 > 2σ(F2)] = 0.0320 restraints
wR(F2) = 0.078H-atom parameters constrained
S = 1.05Δρmax = 0.80 e Å3
4557 reflectionsΔρmin = 1.03 e Å3
260 parameters
Special details top

Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
C10.4386 (5)0.0474 (4)0.3688 (4)0.0261 (10)
C20.5254 (5)0.0617 (4)0.3411 (4)0.0249 (10)
H2A0.63660.03280.31970.030*
H2B0.49650.10350.40440.030*
C30.4790 (5)0.1532 (4)0.2435 (4)0.0228 (9)
H30.57250.17850.18300.027*
C40.4013 (6)0.0707 (4)0.2060 (4)0.0273 (10)
H4A0.30700.11960.19090.033*
H4B0.47080.04250.13840.033*
C110.1952 (5)0.2509 (4)0.4010 (4)0.0244 (10)
C120.2007 (6)0.2481 (6)0.5045 (4)0.0384 (12)
H120.28540.27370.51230.046*
C130.0825 (7)0.2079 (6)0.5970 (4)0.0461 (15)
H130.08720.20580.66780.055*
C140.0408 (6)0.1711 (6)0.5871 (5)0.0434 (14)
H140.12220.14560.65080.052*
C150.0464 (6)0.1714 (6)0.4833 (5)0.0437 (14)
H150.13040.14420.47600.052*
C160.0711 (6)0.2116 (5)0.3913 (4)0.0351 (12)
H160.06720.21230.32050.042*
C210.4479 (5)0.3983 (4)0.3112 (4)0.0253 (10)
C220.5921 (6)0.3606 (5)0.3220 (4)0.0343 (12)
H220.64330.27750.31430.041*
C230.6625 (7)0.4450 (5)0.3441 (5)0.0438 (14)
H230.76190.41950.35120.053*
C240.5882 (7)0.5647 (5)0.3555 (4)0.0394 (13)
H240.63620.62150.37130.047*
C250.4456 (7)0.6029 (5)0.3442 (5)0.0444 (14)
H250.39520.68610.35220.053*
C260.3745 (6)0.5213 (5)0.3213 (5)0.0386 (13)
H260.27610.54850.31240.046*
C310.2836 (5)0.3777 (4)0.1675 (4)0.0256 (10)
C320.3746 (6)0.3662 (5)0.0613 (4)0.0349 (12)
H320.46920.31150.05050.042*
C330.3278 (7)0.4342 (5)0.0284 (5)0.0420 (14)
H330.38900.42410.10040.050*
C340.1938 (7)0.5157 (5)0.0138 (5)0.0439 (14)
H340.16330.56320.07570.053*
C350.1024 (7)0.5292 (5)0.0909 (6)0.0467 (15)
H350.00950.58600.10040.056*
C360.1458 (6)0.4600 (5)0.1820 (5)0.0365 (12)
H360.08230.46860.25390.044*
O10.3662 (4)0.0376 (3)0.2954 (3)0.0303 (7)
O20.4316 (4)0.1369 (3)0.4452 (3)0.0392 (9)
P10.35088 (13)0.29555 (11)0.28121 (10)0.0218 (3)
Te10.00000.00000.00000.02328 (12)
I10.22939 (4)0.16601 (3)0.14044 (3)0.03310 (11)
I20.06205 (4)0.14116 (3)0.17266 (3)0.03253 (11)
I30.23996 (4)0.16762 (3)0.08546 (3)0.03373 (12)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
C10.024 (2)0.027 (2)0.023 (2)0.0060 (19)0.0004 (19)0.005 (2)
C20.027 (3)0.022 (2)0.027 (2)0.0056 (19)0.011 (2)0.0030 (19)
C30.018 (2)0.022 (2)0.026 (2)0.0016 (18)0.0037 (18)0.0059 (19)
C40.029 (3)0.026 (2)0.026 (2)0.003 (2)0.010 (2)0.004 (2)
C110.024 (2)0.027 (2)0.023 (2)0.0039 (19)0.0071 (18)0.0047 (19)
C120.033 (3)0.055 (3)0.031 (3)0.013 (2)0.008 (2)0.010 (3)
C130.045 (3)0.071 (4)0.023 (3)0.019 (3)0.003 (2)0.010 (3)
C140.035 (3)0.056 (4)0.033 (3)0.016 (3)0.001 (2)0.005 (3)
C150.032 (3)0.056 (4)0.043 (3)0.021 (3)0.003 (2)0.009 (3)
C160.030 (3)0.049 (3)0.030 (3)0.014 (2)0.007 (2)0.012 (2)
C210.026 (2)0.026 (2)0.022 (2)0.0076 (19)0.0056 (19)0.0022 (19)
C220.030 (3)0.031 (3)0.042 (3)0.007 (2)0.011 (2)0.006 (2)
C230.037 (3)0.041 (3)0.058 (4)0.013 (2)0.019 (3)0.007 (3)
C240.052 (4)0.040 (3)0.032 (3)0.027 (3)0.012 (2)0.001 (2)
C250.053 (4)0.033 (3)0.052 (4)0.008 (3)0.016 (3)0.015 (3)
C260.036 (3)0.030 (3)0.051 (3)0.000 (2)0.014 (3)0.015 (2)
C310.029 (3)0.019 (2)0.030 (3)0.0039 (18)0.013 (2)0.0010 (19)
C320.036 (3)0.036 (3)0.027 (3)0.001 (2)0.008 (2)0.004 (2)
C330.051 (4)0.045 (3)0.029 (3)0.016 (3)0.013 (2)0.006 (2)
C340.061 (4)0.033 (3)0.045 (3)0.012 (3)0.034 (3)0.007 (3)
C350.051 (4)0.028 (3)0.069 (4)0.008 (2)0.038 (3)0.009 (3)
C360.037 (3)0.029 (3)0.045 (3)0.005 (2)0.018 (2)0.011 (2)
O10.0299 (18)0.0295 (17)0.0345 (19)0.0091 (14)0.0131 (15)0.0034 (15)
O20.051 (2)0.0310 (19)0.034 (2)0.0133 (17)0.0117 (17)0.0003 (17)
P10.0209 (6)0.0212 (6)0.0223 (6)0.0030 (4)0.0060 (5)0.0036 (5)
Te10.0205 (2)0.0252 (2)0.0228 (2)0.00338 (16)0.00399 (16)0.00623 (17)
I10.02691 (19)0.03040 (18)0.0364 (2)0.00844 (13)0.00070 (14)0.00623 (14)
I20.03118 (19)0.0377 (2)0.03201 (19)0.00362 (14)0.00814 (14)0.01573 (15)
I30.02802 (19)0.0372 (2)0.03218 (19)0.00223 (14)0.00940 (14)0.00627 (15)
Geometric parameters (Å, º) top
C1—O21.208 (6)C22—C231.394 (8)
C1—O11.341 (6)C22—H220.9500
C1—C21.498 (6)C23—C241.371 (8)
C2—C31.547 (6)C23—H230.9500
C2—H2A0.9900C24—C251.368 (8)
C2—H2B0.9900C24—H240.9500
C3—C41.549 (7)C25—C261.381 (8)
C3—P11.826 (4)C25—H250.9500
C3—H31.0000C26—H260.9500
C4—O11.446 (6)C31—C321.394 (7)
C4—H4A0.9900C31—C361.397 (7)
C4—H4B0.9900C31—P11.785 (5)
C11—C121.383 (7)C32—C331.386 (7)
C11—C161.392 (7)C32—H320.9500
C11—P11.792 (5)C33—C341.366 (9)
C12—C131.388 (8)C33—H330.9500
C12—H120.9500C34—C351.384 (9)
C13—C141.371 (8)C34—H340.9500
C13—H130.9500C35—C361.388 (8)
C14—C151.395 (8)C35—H350.9500
C14—H140.9500C36—H360.9500
C15—C161.381 (7)Te1—I2i2.9255 (9)
C15—H150.9500Te1—I22.9255 (9)
C16—H160.9500Te1—I12.9417 (12)
C21—C221.380 (7)Te1—I1i2.9417 (12)
C21—C261.398 (7)Te1—I32.9439 (10)
C21—P11.797 (5)Te1—I3i2.9439 (10)
O2—C1—O1121.0 (4)C25—C24—H24119.7
O2—C1—C2127.2 (5)C23—C24—H24119.7
O1—C1—C2111.8 (4)C24—C25—C26120.3 (5)
C1—C2—C3104.3 (4)C24—C25—H25119.8
C1—C2—H2A110.9C26—C25—H25119.8
C3—C2—H2A110.9C25—C26—C21119.7 (5)
C1—C2—H2B110.9C25—C26—H26120.1
C3—C2—H2B110.9C21—C26—H26120.1
H2A—C2—H2B108.9C32—C31—C36119.2 (5)
C2—C3—C4103.4 (3)C32—C31—P1119.4 (4)
C2—C3—P1113.1 (3)C36—C31—P1121.2 (4)
C4—C3—P1111.7 (3)C33—C32—C31120.3 (5)
C2—C3—H3109.5C33—C32—H32119.8
C4—C3—H3109.5C31—C32—H32119.8
P1—C3—H3109.5C34—C33—C32120.2 (6)
O1—C4—C3106.2 (4)C34—C33—H33119.9
O1—C4—H4A110.5C32—C33—H33119.9
C3—C4—H4A110.5C33—C34—C35120.3 (5)
O1—C4—H4B110.5C33—C34—H34119.9
C3—C4—H4B110.5C35—C34—H34119.9
H4A—C4—H4B108.7C34—C35—C36120.3 (5)
C12—C11—C16119.2 (5)C34—C35—H35119.8
C12—C11—P1120.5 (4)C36—C35—H35119.8
C16—C11—P1120.2 (4)C35—C36—C31119.6 (5)
C11—C12—C13120.0 (5)C35—C36—H36120.2
C11—C12—H12120.0C31—C36—H36120.2
C13—C12—H12120.0C1—O1—C4111.5 (4)
C14—C13—C12120.7 (5)C31—P1—C11110.7 (2)
C14—C13—H13119.6C31—P1—C21109.2 (2)
C12—C13—H13119.6C11—P1—C21108.3 (2)
C13—C14—C15119.8 (5)C31—P1—C3107.7 (2)
C13—C14—H14120.1C11—P1—C3109.6 (2)
C15—C14—H14120.1C21—P1—C3111.2 (2)
C16—C15—C14119.4 (5)I2i—Te1—I2180.0
C16—C15—H15120.3I2i—Te1—I191.74 (3)
C14—C15—H15120.3I2—Te1—I188.26 (3)
C15—C16—C11120.8 (5)I2i—Te1—I1i88.26 (3)
C15—C16—H16119.6I2—Te1—I1i91.74 (3)
C11—C16—H16119.6I1—Te1—I1i180.0
C22—C21—C26119.6 (5)I2i—Te1—I387.85 (3)
C22—C21—P1122.3 (4)I2—Te1—I392.15 (3)
C26—C21—P1118.1 (4)I1—Te1—I392.00 (3)
C21—C22—C23119.7 (5)I1i—Te1—I388.00 (3)
C21—C22—H22120.1I2i—Te1—I3i92.15 (3)
C23—C22—H22120.1I2—Te1—I3i87.85 (3)
C24—C23—C22120.1 (5)I1—Te1—I3i88.00 (3)
C24—C23—H23120.0I1i—Te1—I3i92.00 (3)
C22—C23—H23120.0I3—Te1—I3i180.0
C25—C24—C23120.5 (5)
O2—C1—C2—C3174.2 (5)P1—C31—C36—C35175.4 (4)
O1—C1—C2—C36.8 (5)O2—C1—O1—C4174.9 (4)
C1—C2—C3—C414.0 (5)C2—C1—O1—C44.2 (5)
C1—C2—C3—P1107.0 (4)C3—C4—O1—C113.4 (5)
C2—C3—C4—O116.6 (4)C32—C31—P1—C11148.4 (4)
P1—C3—C4—O1105.3 (3)C36—C31—P1—C1135.8 (5)
C16—C11—C12—C130.8 (8)C32—C31—P1—C2192.4 (4)
P1—C11—C12—C13177.1 (5)C36—C31—P1—C2183.4 (4)
C11—C12—C13—C140.3 (9)C32—C31—P1—C328.5 (5)
C12—C13—C14—C151.4 (10)C36—C31—P1—C3155.7 (4)
C13—C14—C15—C161.4 (9)C12—C11—P1—C31146.6 (4)
C14—C15—C16—C110.4 (9)C16—C11—P1—C3137.2 (5)
C12—C11—C16—C150.7 (8)C12—C11—P1—C2126.8 (5)
P1—C11—C16—C15177.0 (4)C16—C11—P1—C21157.0 (4)
C26—C21—C22—C230.8 (8)C12—C11—P1—C394.7 (4)
P1—C21—C22—C23179.3 (4)C16—C11—P1—C381.5 (4)
C21—C22—C23—C240.2 (8)C22—C21—P1—C31129.0 (4)
C22—C23—C24—C250.7 (9)C26—C21—P1—C3149.5 (5)
C23—C24—C25—C260.1 (9)C22—C21—P1—C11110.3 (4)
C24—C25—C26—C211.0 (9)C26—C21—P1—C1171.3 (4)
C22—C21—C26—C251.4 (8)C22—C21—P1—C310.3 (5)
P1—C21—C26—C25179.9 (4)C26—C21—P1—C3168.2 (4)
C36—C31—C32—C331.0 (8)C2—C3—P1—C31170.7 (3)
P1—C31—C32—C33176.8 (4)C4—C3—P1—C3154.5 (4)
C31—C32—C33—C341.7 (9)C2—C3—P1—C1150.1 (4)
C32—C33—C34—C351.2 (9)C4—C3—P1—C1166.0 (4)
C33—C34—C35—C360.1 (9)C2—C3—P1—C2169.6 (4)
C34—C35—C36—C310.8 (8)C4—C3—P1—C21174.2 (3)
C32—C31—C36—C350.3 (8)
Symmetry code: (i) x, y, z.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
C35—H35···I1ii0.953.174.080 (6)161
C16—H16···I20.952.973.839 (5)152
C22—H22···I2iii0.953.093.875 (6)141
C32—H32···I3iii0.953.083.958 (6)155
Symmetry codes: (ii) x, y+1, z; (iii) x+1, y, z.
Selected geometric parameters (Å, º) top
C1—O21.208 (6)Te1—I2i2.9255 (9)
C1—O11.341 (6)Te1—I22.9255 (9)
C3—P11.826 (4)Te1—I12.9417 (12)
C4—O11.446 (6)Te1—I1i2.9417 (12)
C11—P11.792 (5)Te1—I32.9439 (10)
C21—P11.797 (5)Te1—I3i2.9439 (10)
C31—P11.785 (5)
O2—C1—O1121.0 (4)I2—Te1—I188.26 (3)
O2—C1—C2127.2 (5)I2i—Te1—I1i88.26 (3)
O1—C1—C2111.8 (4)I2—Te1—I1i91.74 (3)
O1—C4—C3106.2 (4)I2i—Te1—I387.85 (3)
C1—O1—C4111.5 (4)I2—Te1—I392.15 (3)
C31—P1—C11110.7 (2)I1—Te1—I392.00 (3)
C31—P1—C21109.2 (2)I1i—Te1—I388.00 (3)
C11—P1—C21108.3 (2)I2i—Te1—I3i92.15 (3)
C31—P1—C3107.7 (2)I2—Te1—I3i87.85 (3)
C11—P1—C3109.6 (2)I1—Te1—I3i88.00 (3)
C21—P1—C3111.2 (2)I1i—Te1—I3i92.00 (3)
I2i—Te1—I191.74 (3)
Symmetry code: (i) x, y, z.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
C35—H35···I1ii0.953.174.080 (6)160.5
C16—H16···I20.952.973.839 (5)152.1
C22—H22···I2iii0.953.093.875 (6)140.7
C32—H32···I3iii0.953.083.958 (6)154.9
Symmetry codes: (ii) x, y+1, z; (iii) x+1, y, z.
 

Acknowledgements

Financial support from Academy of Finland is gratefully acknowledged.

References

First citationBrandenburg, K. (2006). DIAMOND. Crystal Impact GmbH, Bonn, Germany.  Google Scholar
First citationFarrugia, L. J. (2012). J. Appl. Cryst. 45, 849–854.  Web of Science CrossRef CAS IUCr Journals Google Scholar
First citationHooft, R. W. W. (1998). COLLECT. Nonius BV, Delft, The Netherlands.  Google Scholar
First citationNärhi, S. M., Malo, K., Oilunkaniemi, R. & Laitinen, R. S. (2013). Polyhedron, 65, 308–315.  Google Scholar
First citationNärhi, S. M., Oilunkaniemi, R., Laitinen, R. S. & Ahlgrén, M. (2004). Inorg. Chem. 43, 3742–3750.  Web of Science PubMed Google Scholar
First citationOtwinowski, Z. & Minor, W. (1997). Methods in Enzymology, Vol. 276, Macromolecular Crystallography, Part A, edited by C. W. Carter Jr & R. M. Sweet, pp. 307–326. New York: Academic Press.  Google Scholar
First citationSheldrick, G. M. (2008). Acta Cryst. A64, 112–122.  Web of Science CrossRef CAS IUCr Journals Google Scholar
First citationSrivastava, P. C., Bajpai, S., Bajpai, S., Ram, C., Kumar, R., Jasinski, J. P. & Butcher, R. J. (2004). J. Organomet. Chem. 689, 194–202.  Web of Science CSD CrossRef CAS Google Scholar

This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.

Journal logoCRYSTALLOGRAPHIC
COMMUNICATIONS
ISSN: 2056-9890
Follow Acta Cryst. E
Sign up for e-alerts
Follow Acta Cryst. on Twitter
Follow us on facebook
Sign up for RSS feeds