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The title compound, [CrSn(C6H5)3(C7H6NO2)3Cl][Sn(C6H5)3Cl(CH4O)], was obtained from the reaction of Ph3SnCl with the complex [Cr(C7H6NO2)3] in methanol. The structure contains [Ph3SnCl(MeOH)] (A) and [Ph3SnClCr(C7H6NO2)3] (B) mol­ecules. In mol­ecule A, the Sn atom of Ph3SnCl is coordinated by one methanol mol­ecule. In mol­ecule B, the Sn atom of Ph3SnCl is coordinated by one carboxyl­ate O atom of [Cr(C7H6NO2)3]. Mol­ecules A and B are connected through an O—H...O hydrogen bond between a carboxyl­ate O atom and the methanol OH group. Weak C—H...Cl inter­actions and O—H...O hydrogen bonds extend the components of (I) into a two-dimensional network.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S0108270106043484/fa3038sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S0108270106043484/fa3038Isup2.hkl
Contains datablock I

CCDC reference: 632916

Comment top

Organotin compounds have attracted much interest, not only because of their applications as catalysts in organic reactions (Orita et al., 1998), but also for use in medicinal chemistry (Arakawa, 1998). For example, the triorganotin compounds, R3SnX, have been known for several years as having a specific action on mitochondrial oxidative phosphorylation (Barnes & Magos, 1968). To the best of our knowledge, little attention (Döring et al., 1997; Yang et al., 2006) has been given to heterobimetallic organotin compounds. It is known that R3Sn+ cations usually prefer a trigonal–bipyramidal (tbp) configuration. Thus, triorganotin compounds are good Lewis acids, despite the fact that they carry three R groups. Given the Lewis acidity of triorganotin compounds, a complex with surplus coordinating atoms can react with triphenyltin to form an adduct. We report here the crystal structure of such a compound, [Ph3SnClCr(C7H6NO2)3][Ph3SnClMeOH], (I).

As shown in Fig. 1, compound (I) possesses two kinds of molecules, [Ph3SnClMeOH] (A) and [Ph3SnClCr(C7H6NO2)3] (B). In molecule A, the Sn atom of Ph3SnCl is coordinated by one methanol molecule, the C atom of which is disordered over two positions with unequal populations for each orientation (the ratio of the occupancies of C58–C59 is 1.27:1). Molecule B contains Ph3SnCl which is coordinated by one carboxylate O atom of a [Cr(C7H6NO2)3] fragment. In the latter, the Cr centre is six-coordinated by N and O atoms of three 6-methylpyridine-2-carboxylate anions, displaying a distorted octahedral configuration. The three N atoms are meridional, as are the three O atoms.

Each Sn atom of (I) shows a trans-ClSn(R3)O trigonal–bipyramidal coordination environment, with three phenyl groups in equatorial positions (C19, C25 and C31 for Sn1, and C1, C7 and C13 for Sn2) and Cl and O atoms in axial positions (Cl1 and O4 for Sn1, and Cl2 and O7 for Sn2). The axial-O—Sn—axial-Cl angles are 179.14 (7) (O4—Sn1—Cl1) and 175.21 (7)° (O7—Sn2—Cl2), so the structures can be described as slightly distorted trigonal bipyramids. Molecules A and B are connected through an O—H···O hydrogen bond between the carboxylate O atom and the hydroxyl H atom of methanol.

In the complex [Cr(C7H6NO2)3], the Cr—O distances of 1.944 (2), 1.957 (2) and 1.931 (2) Å are near the values found in other chromium complexes with pyridine-2-carboxylate (Steams & Armsbong, 1992). However, the Cr—N distances of 2.115 (3), 2.090 (3) and 2.088 (3) Å are somewhat longer. The Sn—O bond distances of (I) are longer than the value found in (Ph3Sn)2O (1.955 Å; Glidewell & Liles, 1978), but shorter than the value in [Sn2(C6H5)6(C8H4O4)] (2.724 Å; Zhang et al., 2006). The Sn—Cl bond distances are significantly longer than those found for Ph3SnCl (2.321 and 2.315 Å; Bokii et al., 1970).

As shown in Fig. 2 and Table 2, molecules B form a one-dimensional zigzag chain via weak C—H···Cl interactions between the C atoms of the pyridine rings and Cl anions bound to Sn atoms. Adjacent one-dimensional chains are parallel to each other. The zigzag chains are connected together through O—H···O hydrogen bonds and weak C—H···Cl interactions between molecules A and B to form a two-dimensional network. There are no ππ interactions between the aromatic rings in the structure of (I).

The molecular structure of (I) can be viewed as a donor–acceptor adduct, in which the electron-rich Cr complex interacts with the electrophilic Sn centre, without causing the loss of Cl anions. It can be predicted that the Lewis acidity of organotin can facilitate the formation of adducts. Thus, it is conceivable that compounds with new properties can be prepared by introducing a second metal into organotin compounds.

Experimental top

A mixture of NaOH (0.012 g, 0.3 mmol) and 6-methylpyridine-2-carboxylic acid (0.041 g, 0.3 mmol) in water (10 ml) was stirred for 10 min, and then CrCl3·6H2O (0.027 g, 0.1 mmol) was added. A purple solid was collected by filtration after stirring for 30 min. The solid was redissolved in methanol (15 ml), and Ph3SnCl (0.039 g, 0.1 mmol) was added to the purple solution. After refluxing for 2 h, the mixture was filtered. Purple block crystals of (I) were obtained by evaporating the filtrate at room temperature for several days.

Refinement top

The H atoms on the disordered methyl group of methanol were not located. Other H atoms bound to carbon were refined using a riding model, with C—H = 0.93 Å and Uiso(H) = 1.2Ueq(C) for aromatic H, and C—H = 0.96 Å and Uiso(H) = 1.5Ueq(C) for methyl H. The hydroxy H atom was located in a difference Fourier map. Its coordinates were refined and its Uiso(H) was set to 1.5 Ueq(O).

Computing details top

Data collection: XSCANS (Siemens, 1996); cell refinement: XSCANS; data reduction: XSCANS; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL-Plus (Sheldrick, 1994); software used to prepare material for publication: SHELXL97.

Figures top
[Figure 1] Fig. 1. The structure of (I). Displacement ellipsoids are drawn at the 30% probability level. The hydrogen bond is drawn as a dashed line. H atoms not involved in this interaction have been omitted.
[Figure 2] Fig. 2. A packing diagram for (I), showing the two-dimensional network formed via weak C—H···Cl interactions and O—H···O hydrogen bonds (dashed lines). [Symmetry codes: (A) ?; (B) ?; (C) ? Please complete]
Chloro(µ-6-methylpyridine-2-carboxylato)bis(6-methylpyridine-2- carboxylato)triphenylchromium(III)tin(IV) chlorotriphenyltin(IV) top
Crystal data top
[CrSn(C6H5)3(C7H6NO2)3Cl][Sn(C6H5)3Cl(CH4O)]Z = 2
Mr = 1263.31F(000) = 1270
Triclinic, P1Dx = 1.475 Mg m3
Hall symbol: -P 1Melting point: not measured K
a = 12.767 (5) ÅMo Kα radiation, λ = 0.71069 Å
b = 14.095 (5) ÅCell parameters from 22 reflections
c = 15.967 (5) Åθ = 1.6–25.0°
α = 96.122 (5)°µ = 1.21 mm1
β = 91.784 (5)°T = 293 K
γ = 94.944 (5)°Block, purple
V = 2843.9 (17) Å30.52 × 0.40 × 0.32 mm
Data collection top
Siemens P4
diffractometer
7137 reflections with I > 2σ(I)
Radiation source: fine-focus sealed tubeRint = 0.020
Graphite monochromatorθmax = 25.0°, θmin = 1.6°
ω scansh = 115
Absorption correction: ψ scan
(North et al., 1968)
k = 1616
Tmin = 0.228, Tmax = 0.303l = 1818
11436 measured reflections3 standard reflections every 97 reflections
9854 independent reflections intensity decay: none
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.033Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.070H atoms treated by a mixture of independent and constrained refinement
S = 0.88 w = 1/[σ2(Fo2) + (0.0263P)2]
where P = (Fo2 + 2Fc2)/3
9854 reflections(Δ/σ)max = 0.006
673 parametersΔρmax = 0.60 e Å3
5 restraintsΔρmin = 0.36 e Å3
Crystal data top
[CrSn(C6H5)3(C7H6NO2)3Cl][Sn(C6H5)3Cl(CH4O)]γ = 94.944 (5)°
Mr = 1263.31V = 2843.9 (17) Å3
Triclinic, P1Z = 2
a = 12.767 (5) ÅMo Kα radiation
b = 14.095 (5) ŵ = 1.21 mm1
c = 15.967 (5) ÅT = 293 K
α = 96.122 (5)°0.52 × 0.40 × 0.32 mm
β = 91.784 (5)°
Data collection top
Siemens P4
diffractometer
7137 reflections with I > 2σ(I)
Absorption correction: ψ scan
(North et al., 1968)
Rint = 0.020
Tmin = 0.228, Tmax = 0.3033 standard reflections every 97 reflections
11436 measured reflections intensity decay: none
9854 independent reflections
Refinement top
R[F2 > 2σ(F2)] = 0.0335 restraints
wR(F2) = 0.070H atoms treated by a mixture of independent and constrained refinement
S = 0.88Δρmax = 0.60 e Å3
9854 reflectionsΔρmin = 0.36 e Å3
673 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.

Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/UeqOcc. (<1)
Cr10.78149 (4)0.27289 (3)0.76728 (3)0.03346 (13)
Sn11.121480 (19)0.042045 (16)0.751782 (15)0.04067 (7)
Sn20.50490 (2)0.667362 (17)0.732214 (15)0.04664 (8)
C10.3456 (3)0.6044 (3)0.7268 (2)0.0495 (9)
C20.3222 (4)0.5056 (3)0.7233 (3)0.0688 (12)
H20.37680.46620.72610.083*
C30.2194 (5)0.4650 (4)0.7158 (3)0.0823 (14)
H30.20570.39880.71350.099*
C40.1398 (5)0.5197 (5)0.7119 (3)0.0859 (16)
H40.07080.49190.70680.103*
C50.1597 (4)0.6161 (4)0.7155 (3)0.0773 (14)
H50.10380.65390.71260.093*
C60.2625 (4)0.6597 (3)0.7234 (2)0.0621 (11)
H60.27460.72600.72630.074*
C70.6184 (3)0.6006 (2)0.6556 (2)0.0490 (9)
C80.6034 (4)0.5921 (3)0.5683 (2)0.0684 (12)
H80.54190.61060.54460.082*
C90.6784 (5)0.5568 (3)0.5166 (3)0.0826 (15)
H90.66730.55090.45840.099*
C100.7686 (5)0.5306 (3)0.5507 (4)0.0878 (16)
H100.81990.50840.51550.105*
C110.7851 (4)0.5364 (3)0.6364 (3)0.0742 (13)
H110.84680.51740.65920.089*
C120.7093 (3)0.5709 (3)0.6885 (3)0.0601 (11)
H120.71990.57410.74670.072*
C130.5587 (3)0.7730 (2)0.8323 (2)0.0479 (9)
C140.6637 (4)0.8053 (3)0.8427 (3)0.0745 (13)
H140.71080.78290.80360.089*
C150.7004 (4)0.8710 (3)0.9108 (4)0.0909 (17)
H150.77170.89110.91750.109*
C160.6320 (6)0.9060 (4)0.9680 (3)0.0965 (19)
H160.65620.94891.01420.116*
C170.5285 (6)0.8769 (4)0.9558 (4)0.128 (3)
H170.48160.90070.99440.154*
C180.4902 (4)0.8127 (4)0.8879 (3)0.0940 (18)
H180.41810.79650.87990.113*
C190.9995 (3)0.0619 (3)0.6968 (2)0.0484 (9)
C200.9533 (3)0.0512 (3)0.6197 (3)0.0615 (11)
H200.97310.00250.59280.074*
C210.8770 (4)0.1202 (4)0.5819 (3)0.0784 (15)
H210.84530.11280.53010.094*
C220.8487 (4)0.2003 (4)0.6223 (4)0.0885 (18)
H220.79740.24640.59740.106*
C230.8955 (4)0.2122 (3)0.6984 (4)0.0883 (16)
H230.87720.26680.72450.106*
C240.9700 (3)0.1428 (3)0.7360 (3)0.0649 (11)
H241.00070.15020.78820.078*
C251.2399 (3)0.0726 (3)0.6646 (2)0.0452 (9)
C261.2889 (3)0.0027 (3)0.6250 (3)0.0636 (11)
H261.27190.06460.63870.076*
C271.3625 (4)0.0129 (4)0.5657 (3)0.0934 (17)
H271.39460.03830.53920.112*
C281.3889 (4)0.1043 (4)0.5452 (3)0.0889 (16)
H281.43890.11480.50530.107*
C291.3416 (4)0.1780 (4)0.5834 (3)0.0812 (15)
H291.35890.23980.56960.097*
C301.2680 (3)0.1628 (3)0.6427 (3)0.0608 (11)
H301.23650.21470.66870.073*
C311.1062 (3)0.1349 (3)0.8637 (2)0.0536 (10)
C321.0476 (4)0.1062 (3)0.9285 (3)0.0733 (13)
H321.01560.04400.92420.088*
C331.0347 (5)0.1689 (5)1.0014 (3)0.101 (2)
H330.99530.14881.04540.121*
C341.0816 (6)0.2597 (6)1.0056 (4)0.125 (3)
H341.07230.30261.05270.150*
C351.1410 (6)0.2892 (4)0.9435 (5)0.129 (3)
H351.17340.35130.94830.155*
C361.1537 (5)0.2264 (3)0.8722 (3)0.0938 (17)
H361.19520.24690.82960.113*
C370.5650 (3)0.2137 (2)0.7928 (2)0.0435 (8)
C380.4730 (3)0.1649 (3)0.8102 (3)0.0596 (11)
H380.41660.19730.82980.072*
C390.4654 (3)0.0658 (3)0.7978 (3)0.0673 (12)
H390.40550.03020.81280.081*
C400.5460 (3)0.0217 (3)0.7637 (3)0.0598 (11)
H400.53910.04450.75070.072*
C410.6392 (3)0.0739 (2)0.7476 (2)0.0459 (9)
C420.5775 (3)0.3209 (3)0.7992 (2)0.0463 (9)
C430.7277 (4)0.0245 (3)0.7095 (3)0.0747 (13)
H43A0.75610.05940.66570.112*
H43B0.70230.03920.68610.112*
H43C0.78160.02140.75210.112*
C440.8921 (3)0.2271 (2)0.6201 (2)0.0424 (8)
C450.9336 (4)0.2255 (3)0.5423 (2)0.0626 (11)
H451.00100.20720.53340.075*
C460.8725 (4)0.2520 (3)0.4771 (2)0.0752 (14)
H460.89840.25160.42330.090*
C470.7750 (4)0.2784 (3)0.4922 (2)0.0642 (11)
H470.73380.29590.44840.077*
C480.7354 (3)0.2797 (2)0.5728 (2)0.0446 (9)
C490.9473 (3)0.1903 (2)0.6929 (2)0.0429 (8)
C500.6272 (3)0.3067 (3)0.5885 (2)0.0552 (10)
H50A0.59200.26180.62170.083*
H50B0.58890.30590.53570.083*
H50C0.63080.36990.61830.083*
C510.8532 (3)0.3930 (2)0.9133 (2)0.0447 (9)
C520.8676 (3)0.4383 (3)0.9945 (2)0.0612 (11)
H520.89630.50151.00440.073*
C530.8387 (4)0.3877 (3)1.0600 (3)0.0760 (14)
H530.84420.41751.11500.091*
C540.8020 (4)0.2938 (3)1.0445 (2)0.0648 (12)
H540.78600.25841.08910.078*
C550.7883 (3)0.2509 (3)0.9622 (2)0.0493 (9)
C560.8881 (3)0.4415 (3)0.8382 (2)0.0469 (9)
C570.7519 (4)0.1464 (3)0.9439 (2)0.0661 (12)
H57A0.67670.13880.93580.099*
H57B0.77230.11320.99040.099*
H57C0.78340.12030.89370.099*
C580.6188 (12)0.5746 (8)0.9132 (10)0.144 (5)0.56
C590.5241 (15)0.5827 (9)0.9262 (8)0.120 (6)0.44
N10.6500 (2)0.17042 (17)0.76501 (16)0.0350 (6)
N20.7955 (2)0.25554 (17)0.63662 (16)0.0362 (6)
N30.8106 (2)0.30178 (19)0.89732 (16)0.0397 (7)
O10.66929 (18)0.35730 (15)0.78253 (14)0.0411 (5)
O20.5032 (2)0.36720 (18)0.8173 (2)0.0701 (8)
O30.89799 (18)0.19122 (16)0.76041 (14)0.0449 (6)
O41.0335 (2)0.15843 (18)0.68137 (16)0.0536 (6)
O50.87799 (19)0.38630 (16)0.76783 (14)0.0455 (6)
O60.9253 (3)0.5240 (2)0.84637 (17)0.0768 (9)
O70.5433 (3)0.56069 (18)0.83625 (17)0.0631 (8)
Cl11.21367 (8)0.07609 (7)0.82594 (6)0.0587 (3)
Cl20.46983 (10)0.78780 (7)0.63496 (6)0.0640 (3)
H7O0.533 (3)0.4995 (15)0.8194 (16)0.096*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Cr10.0348 (3)0.0345 (3)0.0309 (3)0.0026 (2)0.0005 (2)0.0036 (2)
Sn10.03828 (14)0.04065 (14)0.04290 (14)0.00423 (11)0.00309 (11)0.00277 (10)
Sn20.06054 (18)0.03848 (14)0.03995 (14)0.00568 (12)0.00060 (12)0.00023 (10)
C10.064 (3)0.051 (2)0.0328 (19)0.004 (2)0.0022 (18)0.0006 (16)
C20.073 (3)0.056 (3)0.075 (3)0.004 (2)0.004 (3)0.003 (2)
C30.082 (4)0.072 (3)0.085 (3)0.022 (3)0.005 (3)0.004 (3)
C40.074 (4)0.126 (5)0.054 (3)0.015 (4)0.004 (3)0.014 (3)
C50.061 (3)0.122 (5)0.055 (3)0.020 (3)0.008 (2)0.026 (3)
C60.074 (3)0.070 (3)0.046 (2)0.019 (3)0.009 (2)0.016 (2)
C70.068 (3)0.0364 (19)0.044 (2)0.0099 (19)0.007 (2)0.0050 (16)
C80.095 (4)0.066 (3)0.046 (2)0.023 (3)0.001 (2)0.000 (2)
C90.116 (5)0.077 (3)0.056 (3)0.021 (3)0.020 (3)0.000 (2)
C100.104 (4)0.064 (3)0.102 (4)0.028 (3)0.049 (4)0.014 (3)
C110.062 (3)0.062 (3)0.104 (4)0.013 (2)0.015 (3)0.026 (3)
C120.069 (3)0.048 (2)0.066 (3)0.009 (2)0.008 (2)0.013 (2)
C130.059 (3)0.0378 (19)0.046 (2)0.0069 (18)0.0020 (19)0.0003 (16)
C140.065 (3)0.067 (3)0.088 (3)0.014 (2)0.004 (3)0.014 (2)
C150.072 (3)0.071 (3)0.121 (5)0.002 (3)0.043 (3)0.011 (3)
C160.150 (6)0.072 (3)0.058 (3)0.017 (4)0.013 (4)0.012 (3)
C170.136 (6)0.132 (5)0.095 (4)0.039 (5)0.056 (4)0.064 (4)
C180.079 (4)0.098 (4)0.089 (4)0.028 (3)0.032 (3)0.041 (3)
C190.041 (2)0.050 (2)0.050 (2)0.0005 (18)0.0095 (18)0.0152 (17)
C200.055 (3)0.065 (3)0.059 (3)0.013 (2)0.002 (2)0.020 (2)
C210.053 (3)0.103 (4)0.071 (3)0.020 (3)0.008 (2)0.039 (3)
C220.053 (3)0.084 (4)0.114 (5)0.011 (3)0.019 (3)0.047 (3)
C230.072 (4)0.066 (3)0.117 (5)0.020 (3)0.012 (3)0.016 (3)
C240.061 (3)0.059 (3)0.071 (3)0.011 (2)0.014 (2)0.000 (2)
C250.034 (2)0.051 (2)0.053 (2)0.0042 (17)0.0031 (17)0.0134 (17)
C260.065 (3)0.062 (3)0.069 (3)0.019 (2)0.027 (2)0.013 (2)
C270.092 (4)0.105 (4)0.095 (4)0.042 (3)0.052 (3)0.026 (3)
C280.064 (3)0.123 (5)0.089 (4)0.014 (3)0.034 (3)0.039 (3)
C290.063 (3)0.085 (3)0.103 (4)0.003 (3)0.011 (3)0.051 (3)
C300.055 (3)0.053 (2)0.077 (3)0.003 (2)0.003 (2)0.018 (2)
C310.051 (2)0.053 (2)0.055 (2)0.018 (2)0.008 (2)0.0071 (19)
C320.084 (3)0.087 (3)0.051 (3)0.023 (3)0.003 (2)0.001 (2)
C330.118 (5)0.142 (5)0.045 (3)0.057 (4)0.001 (3)0.012 (3)
C340.154 (7)0.128 (6)0.088 (5)0.082 (6)0.050 (5)0.059 (4)
C350.167 (7)0.079 (4)0.128 (6)0.019 (4)0.010 (5)0.046 (4)
C360.112 (4)0.060 (3)0.103 (4)0.006 (3)0.006 (3)0.023 (3)
C370.040 (2)0.044 (2)0.047 (2)0.0068 (17)0.0026 (17)0.0070 (16)
C380.039 (2)0.061 (3)0.082 (3)0.005 (2)0.005 (2)0.021 (2)
C390.044 (2)0.061 (3)0.098 (3)0.012 (2)0.006 (2)0.026 (2)
C400.066 (3)0.038 (2)0.072 (3)0.008 (2)0.012 (2)0.0061 (19)
C410.059 (2)0.0364 (19)0.040 (2)0.0007 (18)0.0045 (18)0.0016 (15)
C420.047 (2)0.044 (2)0.050 (2)0.0108 (19)0.0037 (18)0.0086 (16)
C430.090 (4)0.038 (2)0.095 (3)0.010 (2)0.022 (3)0.006 (2)
C440.047 (2)0.0428 (19)0.0389 (19)0.0127 (17)0.0041 (17)0.0037 (15)
C450.069 (3)0.076 (3)0.049 (2)0.029 (2)0.015 (2)0.013 (2)
C460.092 (4)0.108 (4)0.033 (2)0.038 (3)0.014 (2)0.014 (2)
C470.075 (3)0.085 (3)0.036 (2)0.019 (3)0.004 (2)0.010 (2)
C480.053 (2)0.044 (2)0.0354 (19)0.0068 (18)0.0080 (17)0.0003 (15)
C490.043 (2)0.0382 (19)0.048 (2)0.0085 (17)0.0016 (18)0.0022 (16)
C500.049 (2)0.073 (3)0.044 (2)0.011 (2)0.0128 (18)0.0109 (19)
C510.045 (2)0.048 (2)0.0397 (19)0.0018 (18)0.0002 (17)0.0004 (16)
C520.078 (3)0.059 (2)0.044 (2)0.005 (2)0.000 (2)0.0066 (19)
C530.105 (4)0.082 (3)0.037 (2)0.003 (3)0.003 (2)0.009 (2)
C540.081 (3)0.080 (3)0.033 (2)0.003 (3)0.005 (2)0.012 (2)
C550.051 (2)0.061 (2)0.037 (2)0.0031 (19)0.0001 (17)0.0104 (17)
C560.049 (2)0.045 (2)0.042 (2)0.0124 (18)0.0019 (18)0.0026 (17)
C570.089 (3)0.062 (3)0.047 (2)0.011 (2)0.007 (2)0.0219 (19)
C580.152 (13)0.074 (7)0.206 (15)0.016 (8)0.020 (12)0.016 (8)
C590.192 (16)0.085 (9)0.112 (11)0.073 (10)0.091 (11)0.064 (8)
N10.0408 (16)0.0301 (14)0.0341 (14)0.0027 (12)0.0005 (12)0.0050 (11)
N20.0418 (17)0.0348 (14)0.0325 (14)0.0066 (13)0.0009 (13)0.0035 (11)
N30.0389 (17)0.0460 (16)0.0337 (15)0.0006 (14)0.0001 (13)0.0046 (12)
O10.0441 (15)0.0335 (12)0.0458 (14)0.0046 (11)0.0042 (11)0.0035 (10)
O20.0524 (17)0.0529 (16)0.110 (2)0.0219 (14)0.0256 (17)0.0133 (16)
O30.0437 (14)0.0564 (15)0.0388 (13)0.0148 (12)0.0043 (12)0.0149 (11)
O40.0451 (16)0.0617 (16)0.0590 (16)0.0222 (13)0.0078 (13)0.0143 (13)
O50.0494 (15)0.0490 (14)0.0353 (13)0.0094 (12)0.0009 (11)0.0036 (11)
O60.100 (2)0.0570 (17)0.0649 (19)0.0304 (17)0.0063 (17)0.0019 (14)
O70.087 (2)0.0505 (15)0.0537 (17)0.0108 (16)0.0015 (16)0.0134 (13)
Cl10.0593 (6)0.0533 (5)0.0678 (6)0.0097 (5)0.0002 (5)0.0234 (5)
Cl20.0925 (8)0.0451 (5)0.0555 (6)0.0069 (5)0.0070 (6)0.0122 (4)
Geometric parameters (Å, º) top
Cr1—O11.944 (2)C28—H280.9300
Cr1—O31.957 (2)C29—C301.375 (6)
Cr1—O51.931 (2)C29—H290.9300
Cr1—N12.115 (3)C30—H300.9300
Cr1—N22.090 (3)C31—C361.370 (6)
Cr1—N32.088 (3)C31—C321.370 (6)
Sn1—C312.124 (4)C32—C331.407 (6)
Sn1—C252.135 (3)C32—H320.9300
Sn1—C192.143 (4)C33—C341.360 (9)
Sn1—O42.419 (2)C33—H330.9300
Sn1—Cl12.4963 (11)C34—C351.347 (9)
Sn2—C132.119 (4)C34—H340.9300
Sn2—C72.140 (4)C35—C361.388 (7)
Sn2—C12.143 (4)C35—H350.9300
Sn2—O72.423 (3)C36—H360.9300
Sn2—Cl22.4786 (11)C37—N11.354 (4)
C1—C61.373 (5)C37—C381.360 (5)
C1—C21.394 (5)C37—C421.498 (5)
C2—C31.382 (6)C38—C391.384 (5)
C2—H20.9300C38—H380.9300
C3—C41.332 (7)C39—C401.347 (6)
C3—H30.9300C39—H390.9300
C4—C51.355 (7)C40—C411.391 (5)
C4—H40.9300C40—H400.9300
C5—C61.396 (6)C41—N11.353 (4)
C5—H50.9300C41—C431.489 (5)
C6—H60.9300C42—O21.221 (4)
C7—C121.376 (5)C42—O11.285 (4)
C7—C81.392 (5)C43—H43A0.9600
C8—C91.374 (6)C43—H43B0.9600
C8—H80.9300C43—H43C0.9600
C9—C101.354 (7)C44—N21.354 (4)
C9—H90.9300C44—C451.363 (5)
C10—C111.370 (7)C44—C491.503 (5)
C10—H100.9300C45—C461.384 (6)
C11—C121.383 (6)C45—H450.9300
C11—H110.9300C46—C471.351 (6)
C12—H120.9300C46—H460.9300
C13—C141.377 (6)C47—C481.395 (5)
C13—C181.377 (6)C47—H470.9300
C14—C151.392 (6)C48—N21.347 (4)
C14—H140.9300C48—C501.486 (5)
C15—C161.366 (7)C49—O41.235 (4)
C15—H150.9300C49—O31.265 (4)
C16—C171.351 (8)C50—H50A0.9600
C16—H160.9300C50—H50B0.9600
C17—C181.384 (7)C50—H50C0.9600
C17—H170.9300C51—N31.347 (4)
C18—H180.9300C51—C521.382 (5)
C19—C201.377 (5)C51—C561.503 (5)
C19—C241.388 (5)C52—C531.370 (6)
C20—C211.391 (6)C52—H520.9300
C20—H200.9300C53—C541.359 (6)
C21—C221.384 (7)C53—H530.9300
C21—H210.9300C54—C551.387 (5)
C22—C231.371 (7)C54—H540.9300
C22—H220.9300C55—N31.346 (4)
C23—C241.379 (6)C55—C571.500 (5)
C23—H230.9300C56—O61.210 (4)
C24—H240.9300C56—O51.293 (4)
C25—C301.375 (5)C57—H57A0.9600
C25—C261.383 (5)C57—H57B0.9600
C26—C271.377 (6)C57—H57C0.9600
C26—H260.9300C58—O71.522 (12)
C27—C281.378 (7)C59—O71.469 (11)
C27—H270.9300O7—H7O0.873 (18)
C28—C291.347 (7)
O5—Cr1—O187.58 (10)C29—C28—H28120.3
O5—Cr1—O391.03 (11)C27—C28—H28120.3
O1—Cr1—O3175.81 (10)C28—C29—C30120.5 (4)
O5—Cr1—N381.46 (10)C28—C29—H29119.8
O1—Cr1—N385.98 (10)C30—C29—H29119.8
O3—Cr1—N389.91 (10)C29—C30—C25121.5 (4)
O5—Cr1—N286.46 (10)C29—C30—H30119.2
O1—Cr1—N2103.20 (10)C25—C30—H30119.2
O3—Cr1—N280.64 (10)C36—C31—C32118.1 (4)
N3—Cr1—N2164.53 (11)C36—C31—Sn1120.3 (3)
O5—Cr1—N1167.22 (11)C32—C31—Sn1121.6 (3)
O1—Cr1—N179.85 (10)C31—C32—C33121.5 (5)
O3—Cr1—N1101.67 (11)C31—C32—H32119.3
N3—Cr1—N199.81 (10)C33—C32—H32119.3
N2—Cr1—N194.11 (10)C34—C33—C32117.9 (6)
C31—Sn1—C25121.44 (16)C34—C33—H33121.0
C31—Sn1—C19124.04 (15)C32—C33—H33121.0
C25—Sn1—C19112.05 (14)C35—C34—C33121.8 (6)
C31—Sn1—O485.42 (12)C35—C34—H34119.1
C25—Sn1—O482.19 (11)C33—C34—H34119.1
C19—Sn1—O486.64 (13)C34—C35—C36119.7 (7)
C31—Sn1—Cl193.88 (11)C34—C35—H35120.2
C25—Sn1—Cl197.77 (10)C36—C35—H35120.2
C19—Sn1—Cl194.17 (11)C31—C36—C35121.0 (6)
O4—Sn1—Cl1179.14 (7)C31—C36—H36119.5
C13—Sn2—C7118.75 (15)C35—C36—H36119.5
C13—Sn2—C1120.07 (14)N1—C37—C38123.4 (3)
C7—Sn2—C1119.49 (14)N1—C37—C42114.8 (3)
C13—Sn2—O782.03 (12)C38—C37—C42121.7 (3)
C7—Sn2—O787.40 (12)C37—C38—C39118.3 (4)
C1—Sn2—O787.59 (13)C37—C38—H38120.8
C13—Sn2—Cl293.19 (10)C39—C38—H38120.8
C7—Sn2—Cl295.15 (10)C40—C39—C38119.1 (4)
C1—Sn2—Cl294.65 (10)C40—C39—H39120.5
O7—Sn2—Cl2175.21 (7)C38—C39—H39120.5
C6—C1—C2117.3 (4)C39—C40—C41120.8 (4)
C6—C1—Sn2121.2 (3)C39—C40—H40119.6
C2—C1—Sn2121.5 (3)C41—C40—H40119.6
C3—C2—C1121.2 (4)N1—C41—C40120.4 (3)
C3—C2—H2119.4N1—C41—C43119.2 (3)
C1—C2—H2119.4C40—C41—C43120.4 (3)
C4—C3—C2120.6 (5)O2—C42—O1124.7 (3)
C4—C3—H3119.7O2—C42—C37120.4 (3)
C2—C3—H3119.7O1—C42—C37114.9 (3)
C3—C4—C5119.7 (5)C41—C43—H43A109.5
C3—C4—H4120.2C41—C43—H43B109.5
C5—C4—H4120.2H43A—C43—H43B109.5
C4—C5—C6121.3 (5)C41—C43—H43C109.5
C4—C5—H5119.3H43A—C43—H43C109.5
C6—C5—H5119.3H43B—C43—H43C109.5
C1—C6—C5119.8 (4)N2—C44—C45123.2 (3)
C1—C6—H6120.1N2—C44—C49114.5 (3)
C5—C6—H6120.1C45—C44—C49122.2 (3)
C12—C7—C8118.1 (4)C44—C45—C46118.0 (4)
C12—C7—Sn2122.9 (3)C44—C45—H45121.0
C8—C7—Sn2118.9 (3)C46—C45—H45121.0
C9—C8—C7120.8 (4)C47—C46—C45119.5 (4)
C9—C8—H8119.6C47—C46—H46120.2
C7—C8—H8119.6C45—C46—H46120.2
C10—C9—C8119.9 (5)C46—C47—C48120.8 (4)
C10—C9—H9120.1C46—C47—H47119.6
C8—C9—H9120.1C48—C47—H47119.6
C9—C10—C11120.9 (5)N2—C48—C47119.7 (3)
C9—C10—H10119.6N2—C48—C50119.8 (3)
C11—C10—H10119.6C47—C48—C50120.6 (3)
C10—C11—C12119.4 (5)O4—C49—O3125.6 (3)
C10—C11—H11120.3O4—C49—C44118.3 (3)
C12—C11—H11120.3O3—C49—C44115.9 (3)
C7—C12—C11120.9 (4)C48—C50—H50A109.5
C7—C12—H12119.5C48—C50—H50B109.5
C11—C12—H12119.5H50A—C50—H50B109.5
C14—C13—C18117.8 (4)C48—C50—H50C109.5
C14—C13—Sn2120.8 (3)H50A—C50—H50C109.5
C18—C13—Sn2121.4 (3)H50B—C50—H50C109.5
C13—C14—C15121.0 (5)N3—C51—C52121.8 (3)
C13—C14—H14119.5N3—C51—C56116.3 (3)
C15—C14—H14119.5C52—C51—C56121.9 (3)
C14—C15—C16120.3 (5)C53—C52—C51118.4 (4)
C14—C15—H15119.9C53—C52—H52120.8
C16—C15—H15119.9C51—C52—H52120.8
C17—C16—C15118.5 (5)C54—C53—C52119.9 (4)
C17—C16—H16120.7C54—C53—H53120.1
C15—C16—H16120.7C52—C53—H53120.1
C16—C17—C18122.2 (5)C53—C54—C55120.0 (4)
C16—C17—H17118.9C53—C54—H54120.0
C18—C17—H17118.9C55—C54—H54120.0
C17—C18—C13119.9 (5)N3—C55—C54120.3 (3)
C17—C18—H18120.0N3—C55—C57118.9 (3)
C13—C18—H18120.0C54—C55—C57120.8 (3)
C20—C19—C24119.4 (4)O6—C56—O5125.1 (3)
C20—C19—Sn1119.9 (3)O6—C56—C51120.8 (3)
C24—C19—Sn1120.7 (3)O5—C56—C51114.0 (3)
C19—C20—C21120.3 (4)C55—C57—H57A109.5
C19—C20—H20119.9C55—C57—H57B109.5
C21—C20—H20119.9H57A—C57—H57B109.5
C22—C21—C20119.3 (5)C55—C57—H57C109.5
C22—C21—H21120.3H57A—C57—H57C109.5
C20—C21—H21120.3H57B—C57—H57C109.5
C23—C22—C21120.7 (5)C41—N1—C37117.6 (3)
C23—C22—H22119.6C41—N1—Cr1132.4 (2)
C21—C22—H22119.6C37—N1—Cr1109.8 (2)
C22—C23—C24119.6 (5)C48—N2—C44118.7 (3)
C22—C23—H23120.2C48—N2—Cr1132.2 (2)
C24—C23—H23120.2C44—N2—Cr1108.3 (2)
C23—C24—C19120.7 (5)C55—N3—C51119.3 (3)
C23—C24—H24119.7C55—N3—Cr1132.7 (2)
C19—C24—H24119.7C51—N3—Cr1107.8 (2)
C30—C25—C26117.6 (4)C42—O1—Cr1118.5 (2)
C30—C25—Sn1123.8 (3)C49—O3—Cr1115.2 (2)
C26—C25—Sn1118.5 (3)C49—O4—Sn1130.9 (2)
C27—C26—C25120.6 (4)C56—O5—Cr1115.5 (2)
C27—C26—H26119.7C59—O7—Sn2122.6 (5)
C25—C26—H26119.7C58—O7—Sn2131.2 (5)
C28—C27—C26120.3 (5)C59—O7—H7O113 (2)
C28—C27—H27119.8C58—O7—H7O109 (2)
C26—C27—H27119.8Sn2—O7—H7O115.9 (19)
C29—C28—C27119.4 (4)
C13—Sn2—C1—C658.8 (3)C38—C37—C42—O1178.7 (3)
C7—Sn2—C1—C6136.2 (3)N2—C44—C45—C461.7 (6)
O7—Sn2—C1—C6138.1 (3)C49—C44—C45—C46173.7 (4)
Cl2—Sn2—C1—C637.6 (3)C44—C45—C46—C470.1 (7)
C13—Sn2—C1—C2123.8 (3)C45—C46—C47—C480.3 (7)
C7—Sn2—C1—C241.2 (3)C46—C47—C48—N20.8 (6)
O7—Sn2—C1—C244.4 (3)C46—C47—C48—C50178.6 (4)
Cl2—Sn2—C1—C2139.8 (3)N2—C44—C49—O4176.3 (3)
C6—C1—C2—C30.6 (6)C45—C44—C49—O40.6 (5)
Sn2—C1—C2—C3176.9 (3)N2—C44—C49—O30.7 (4)
C1—C2—C3—C40.1 (7)C45—C44—C49—O3176.4 (3)
C2—C3—C4—C50.1 (8)N3—C51—C52—C530.8 (6)
C3—C4—C5—C60.2 (7)C56—C51—C52—C53176.6 (4)
C2—C1—C6—C50.9 (5)C51—C52—C53—C543.4 (7)
Sn2—C1—C6—C5176.7 (3)C52—C53—C54—C553.6 (7)
C4—C5—C6—C10.7 (6)C53—C54—C55—N30.4 (7)
C13—Sn2—C7—C1243.0 (3)C53—C54—C55—C57177.6 (4)
C1—Sn2—C7—C12122.2 (3)N3—C51—C56—O6178.6 (4)
O7—Sn2—C7—C1236.5 (3)C52—C51—C56—O63.9 (6)
Cl2—Sn2—C7—C12139.5 (3)N3—C51—C56—O53.8 (5)
C13—Sn2—C7—C8132.8 (3)C52—C51—C56—O5173.7 (4)
C1—Sn2—C7—C862.0 (3)C40—C41—N1—C374.4 (5)
O7—Sn2—C7—C8147.7 (3)C43—C41—N1—C37174.5 (3)
Cl2—Sn2—C7—C836.3 (3)C40—C41—N1—Cr1169.7 (3)
C12—C7—C8—C91.3 (6)C43—C41—N1—Cr111.4 (5)
Sn2—C7—C8—C9174.7 (3)C38—C37—N1—C415.3 (5)
C7—C8—C9—C100.6 (7)C42—C37—N1—C41171.7 (3)
C8—C9—C10—C111.8 (8)C38—C37—N1—Cr1170.1 (3)
C9—C10—C11—C121.0 (7)C42—C37—N1—Cr112.9 (3)
C8—C7—C12—C112.0 (6)O5—Cr1—N1—C41161.7 (4)
Sn2—C7—C12—C11173.8 (3)O1—Cr1—N1—C41172.3 (3)
C10—C11—C12—C70.9 (6)O3—Cr1—N1—C4111.7 (3)
C7—Sn2—C13—C146.6 (4)N3—Cr1—N1—C41103.6 (3)
C1—Sn2—C13—C14171.7 (3)N2—Cr1—N1—C4169.6 (3)
O7—Sn2—C13—C1489.2 (3)O5—Cr1—N1—C3723.8 (6)
Cl2—Sn2—C13—C1491.1 (3)O1—Cr1—N1—C3713.2 (2)
C7—Sn2—C13—C18174.6 (4)O3—Cr1—N1—C37162.8 (2)
C1—Sn2—C13—C189.5 (4)N3—Cr1—N1—C3770.9 (2)
O7—Sn2—C13—C1892.0 (4)N2—Cr1—N1—C37115.9 (2)
Cl2—Sn2—C13—C1887.7 (4)C47—C48—N2—C442.4 (5)
C18—C13—C14—C154.6 (7)C50—C48—N2—C44177.1 (3)
Sn2—C13—C14—C15176.6 (4)C47—C48—N2—Cr1166.1 (3)
C13—C14—C15—C161.2 (8)C50—C48—N2—Cr114.4 (5)
C14—C15—C16—C171.3 (9)C45—C44—N2—C482.9 (5)
C15—C16—C17—C180.3 (10)C49—C44—N2—C48172.8 (3)
C16—C17—C18—C133.1 (10)C45—C44—N2—Cr1168.1 (3)
C14—C13—C18—C175.4 (8)C49—C44—N2—Cr116.2 (3)
Sn2—C13—C18—C17175.8 (5)O5—Cr1—N2—C4897.0 (3)
C31—Sn1—C19—C20113.4 (3)O1—Cr1—N2—C4810.4 (3)
C25—Sn1—C19—C2049.0 (3)O3—Cr1—N2—C48171.3 (3)
O4—Sn1—C19—C2031.2 (3)N3—Cr1—N2—C48135.6 (4)
Cl1—Sn1—C19—C20149.1 (3)N1—Cr1—N2—C4870.2 (3)
C31—Sn1—C19—C2469.9 (3)O5—Cr1—N2—C4472.3 (2)
C25—Sn1—C19—C24127.8 (3)O1—Cr1—N2—C44159.0 (2)
O4—Sn1—C19—C24152.0 (3)O3—Cr1—N2—C4419.3 (2)
Cl1—Sn1—C19—C2427.7 (3)N3—Cr1—N2—C4433.7 (5)
C24—C19—C20—C210.6 (6)N1—Cr1—N2—C44120.5 (2)
Sn1—C19—C20—C21177.4 (3)C54—C55—N3—C514.5 (5)
C19—C20—C21—C220.5 (6)C57—C55—N3—C51173.5 (3)
C20—C21—C22—C230.4 (7)C54—C55—N3—Cr1169.5 (3)
C21—C22—C23—C241.4 (7)C57—C55—N3—Cr112.6 (5)
C22—C23—C24—C191.3 (7)C52—C51—N3—C554.7 (5)
C20—C19—C24—C230.3 (6)C56—C51—N3—C55172.8 (3)
Sn1—C19—C24—C23176.4 (3)C52—C51—N3—Cr1170.6 (3)
C31—Sn1—C25—C3040.1 (4)C56—C51—N3—Cr111.9 (4)
C19—Sn1—C25—C30122.7 (3)O5—Cr1—N3—C55168.6 (3)
O4—Sn1—C25—C3039.6 (3)O1—Cr1—N3—C55103.3 (3)
Cl1—Sn1—C25—C30139.5 (3)O3—Cr1—N3—C5577.5 (3)
C31—Sn1—C25—C26142.4 (3)N2—Cr1—N3—C55129.5 (4)
C19—Sn1—C25—C2654.8 (3)N1—Cr1—N3—C5524.3 (3)
O4—Sn1—C25—C26137.9 (3)O5—Cr1—N3—C5117.0 (2)
Cl1—Sn1—C25—C2643.0 (3)O1—Cr1—N3—C5171.2 (2)
C30—C25—C26—C270.4 (6)O3—Cr1—N3—C51108.0 (2)
Sn1—C25—C26—C27177.2 (4)N2—Cr1—N3—C5156.0 (5)
C25—C26—C27—C280.4 (8)N1—Cr1—N3—C51150.1 (2)
C26—C27—C28—C290.4 (9)O2—C42—O1—Cr1173.3 (3)
C27—C28—C29—C300.3 (8)C37—C42—O1—Cr18.2 (4)
C28—C29—C30—C250.3 (7)O5—Cr1—O1—C42170.4 (2)
C26—C25—C30—C290.4 (6)N3—Cr1—O1—C4288.8 (2)
Sn1—C25—C30—C29177.1 (3)N2—Cr1—O1—C42103.8 (2)
C25—Sn1—C31—C3616.1 (4)N1—Cr1—O1—C4212.0 (2)
C19—Sn1—C31—C36144.7 (4)O4—C49—O3—Cr1166.1 (3)
O4—Sn1—C31—C3661.8 (4)C44—C49—O3—Cr117.1 (4)
Cl1—Sn1—C31—C36117.7 (4)O5—Cr1—O3—C4965.8 (2)
C25—Sn1—C31—C32165.1 (3)N3—Cr1—O3—C49147.3 (2)
C19—Sn1—C31—C3234.2 (4)N2—Cr1—O3—C4920.4 (2)
O4—Sn1—C31—C32117.0 (3)N1—Cr1—O3—C49112.7 (2)
Cl1—Sn1—C31—C3263.5 (3)O3—C49—O4—Sn122.9 (5)
C36—C31—C32—C331.0 (7)C44—C49—O4—Sn1153.8 (2)
Sn1—C31—C32—C33177.9 (3)C31—Sn1—O4—C4957.0 (3)
C31—C32—C33—C340.6 (8)C25—Sn1—O4—C49179.6 (3)
C32—C33—C34—C351.7 (10)C19—Sn1—O4—C4967.5 (3)
C33—C34—C35—C361.3 (11)O6—C56—O5—Cr1162.9 (3)
C32—C31—C36—C351.5 (8)C51—C56—O5—Cr119.6 (4)
Sn1—C31—C36—C35177.4 (5)O1—Cr1—O5—C5665.6 (3)
C34—C35—C36—C310.4 (10)O3—Cr1—O5—C56110.5 (3)
N1—C37—C38—C390.8 (6)N3—Cr1—O5—C5620.7 (3)
C42—C37—C38—C39176.0 (4)N2—Cr1—O5—C56169.0 (3)
C37—C38—C39—C404.6 (6)N1—Cr1—O5—C5676.0 (5)
C38—C39—C40—C415.4 (6)C13—Sn2—O7—C5937.2 (10)
C39—C40—C41—N10.8 (6)C7—Sn2—O7—C59156.7 (10)
C39—C40—C41—C43179.7 (4)C1—Sn2—O7—C5983.6 (10)
N1—C37—C42—O2174.3 (3)C13—Sn2—O7—C5824.7 (9)
C38—C37—C42—O22.7 (6)C7—Sn2—O7—C5894.8 (9)
N1—C37—C42—O14.2 (4)C1—Sn2—O7—C58145.5 (9)
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
O7—H7O···O20.87 (2)1.87 (2)2.714 (4)163 (3)
C39—H39···Cl1i0.932.783.702 (4)169
C40—H40···Cl2ii0.932.903.730 (4)150
Symmetry codes: (i) x1, y, z; (ii) x, y1, z.

Experimental details

Crystal data
Chemical formula[CrSn(C6H5)3(C7H6NO2)3Cl][Sn(C6H5)3Cl(CH4O)]
Mr1263.31
Crystal system, space groupTriclinic, P1
Temperature (K)293
a, b, c (Å)12.767 (5), 14.095 (5), 15.967 (5)
α, β, γ (°)96.122 (5), 91.784 (5), 94.944 (5)
V3)2843.9 (17)
Z2
Radiation typeMo Kα
µ (mm1)1.21
Crystal size (mm)0.52 × 0.40 × 0.32
Data collection
DiffractometerSiemens P4
diffractometer
Absorption correctionψ scan
(North et al., 1968)
Tmin, Tmax0.228, 0.303
No. of measured, independent and
observed [I > 2σ(I)] reflections
11436, 9854, 7137
Rint0.020
(sin θ/λ)max1)0.595
Refinement
R[F2 > 2σ(F2)], wR(F2), S 0.033, 0.070, 0.88
No. of reflections9854
No. of parameters673
No. of restraints5
H-atom treatmentH atoms treated by a mixture of independent and constrained refinement
Δρmax, Δρmin (e Å3)0.60, 0.36

Computer programs: XSCANS (Siemens, 1996), XSCANS, SHELXS97 (Sheldrick, 1997), SHELXL97 (Sheldrick, 1997), SHELXTL-Plus (Sheldrick, 1994), SHELXL97.

Selected geometric parameters (Å, º) top
Cr1—O11.944 (2)Cr1—N32.088 (3)
Cr1—O31.957 (2)Sn1—O42.419 (2)
Cr1—O51.931 (2)Sn1—Cl12.4963 (11)
Cr1—N12.115 (3)Sn2—O72.423 (3)
Cr1—N22.090 (3)Sn2—Cl22.4786 (11)
O4—Sn1—Cl1179.14 (7)O7—Sn2—Cl2175.21 (7)
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
O7—H7O···O20.873 (18)1.87 (2)2.714 (4)163 (3)
C39—H39···Cl1i0.932.783.702 (4)169.1
C40—H40···Cl2ii0.932.903.730 (4)149.8
Symmetry codes: (i) x1, y, z; (ii) x, y1, z.
 

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