Aqua­tri­phenyl­(tri­fluoro­acetato)­tin–2,4,6-tris(2-pyridyl)-1,3,5-triazine (1/1)

The water-coordinated Sn atom in the title compound, [Sn(C₂F₃O₂)(C₆H₅)₃(H₂O)]·C₁₈H₁₂N₆, forms hydrogen bonds to two of the pyridyl N atoms of the N-heterocycle [O_water...N = 2.841 (4) and 2.826 (4) Å]. The Sn atom shows trans-C₃SnO₂ trigonal bipyramidal coordination.

Key indicators

• Single-crystal X-ray study
• T = 168 K
• Mean [sigma](C-C) = 0.006 Å
• R factor = 0.040
• wR factor = 0.095
• Data-to-parameter ratio = 14.4

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


 Alert Level C:



PLAT_213  Alert C Atom F3      has ADP max/min Ratio ...........       3.10 prolate

PLAT_735  Alert C D-H     Calc     0.85(3), Rep   0.850(10) ....       3.00 su-Ratio
                     O1W  -H1W2    1.555   1.555

PLAT_736  Alert C H...A   Calc     2.00(3), Rep   2.000(10) ....       3.00 su-Ratio
                     H1W1 -N4      1.555   1.555

PLAT_736  Alert C H...A   Calc     1.98(3), Rep   1.980(10) ....       3.00 su-Ratio
                     H1W2 -N6      1.555   1.555

General Notes



FORMU_01  There is a discrepancy between the atom counts in the
          _chemical_formula_sum and _chemical_formula_moiety. This is
          usually due to the moiety formula being in the wrong format.
          Atom count from _chemical_formula_sum:   C38 H29 F3 N6 O3 Sn1
          Atom count from _chemical_formula_moiety:


 0 Alert Level A = Potentially serious problem

 0 Alert Level B = Potential problem

 4 Alert Level C = Please check

---

Computing details

Data collection: SMART (Bruker, 1997); cell refinement: SAINT (Bruker, 1997); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEPII (Johnson, 1976); software used to prepare material for publication: SHELXL97.

Aquatriphenyl(trifluoroacetato)tin–2,4,6-tris(2-pyridyl)-1,3,5-triazine (1/1)

Crystal data

[Sn(C2F3O2)(C6H5)3(H2O)]·C18H12N6	Z = 2
Mr = 793.36	F(000) = 800
Triclinic, P1	Dx = 1.58 Mg m^−3
Hall symbol: -P 1	Mo Kα radiation, λ = 0.71073 Å
a = 10.567 (1) Å	Cell parameters from 7791 reflections
b = 11.053 (1) Å	θ = 2.0–26.4°
c = 15.438 (1) Å	µ = 0.83 mm^−1
α = 105.559 (2)°	T = 168 K
β = 97.496 (2)°	Block, light yellow
γ = 101.637 (2)°	0.30 × 0.19 × 0.10 mm
V = 1668.5 (2) Å^3

Data collection

Bruker CCD area-detector diffractometer	6720 independent reflections
Radiation source: fine-focus sealed tube	5013 reflections with I > 2σ(I)
Graphite monochromator	Rint = 0.063
ω scans	θmax = 26.4°, θmin = 2.0°
Absorption correction: empirical (using intensity measurements) (SADABS; Sheldrick, 1996)	h = −13→13
Tmin = 0.789, Tmax = 0.922	k = −13→7
21865 measured reflections	l = −19→19

Refinement

Refinement on F^2	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F^2 > 2σ(F^2)] = 0.040	Hydrogen site location: inferred from neighbouring sites
wR(F^2) = 0.095	H atoms treated by a mixture of independent and constrained refinement
S = 0.93	w = 1/[σ^2(Fo^2) + (0.0525P)^2] where P = (Fo^2 + 2Fc^2)/3
6720 reflections	(Δ/σ)max = 0.001
468 parameters	Δρmax = 1.43 e Å^−3
2 restraints	Δρmin = −1.49 e Å^−3

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Ų)

	x	y	z	Uiso*/Ueq
Sn1	0.38923 (3)	0.22641 (3)	0.23754 (2)	0.0228 (1)
F1	0.1034 (4)	0.5203 (4)	0.1039 (3)	0.115 (2)
F2	0.1592 (4)	0.3974 (3)	−0.0027 (2)	0.100 (1)
F3	0.3001 (4)	0.5443 (4)	0.0984 (3)	0.129 (2)
O1	0.3140 (3)	0.3457 (3)	0.1580 (2)	0.036 (1)
O2	0.0983 (3)	0.3084 (3)	0.1585 (2)	0.040 (1)
O1w	0.4850 (3)	0.1014 (3)	0.3113 (2)	0.025 (1)
N1	0.4141 (3)	0.1003 (3)	0.4879 (2)	0.025 (1)
N2	0.4552 (3)	0.1901 (3)	0.6492 (2)	0.027 (1)
N3	0.2566 (3)	0.0324 (3)	0.5729 (2)	0.028 (1)
N4	0.6520 (3)	0.2458 (3)	0.4832 (2)	0.027 (1)
N5	0.2105 (3)	0.0127 (3)	0.7407 (2)	0.035 (1)
N6	0.2619 (3)	−0.0715 (3)	0.3311 (2)	0.025 (1)
C1	0.2914 (4)	0.2767 (4)	0.3495 (2)	0.024 (1)
C2	0.3618 (4)	0.3575 (4)	0.4343 (3)	0.029 (1)
C3	0.3026 (4)	0.3793 (4)	0.5108 (3)	0.034 (1)
C4	0.1724 (4)	0.3187 (4)	0.5025 (3)	0.036 (1)
C5	0.0998 (4)	0.2364 (4)	0.4186 (3)	0.036 (1)
C6	0.1595 (4)	0.2166 (4)	0.3432 (3)	0.030 (1)
C7	0.5824 (3)	0.3311 (4)	0.2372 (2)	0.023 (1)
C8	0.6907 (4)	0.2770 (4)	0.2475 (3)	0.030 (1)
C9	0.8146 (4)	0.3421 (4)	0.2418 (3)	0.035 (1)
C10	0.8333 (4)	0.4584 (4)	0.2250 (3)	0.039 (1)
C11	0.7284 (4)	0.5127 (4)	0.2144 (3)	0.044 (1)
C12	0.6042 (4)	0.4496 (4)	0.2207 (3)	0.036 (1)
C13	0.3007 (4)	0.0515 (4)	0.1308 (2)	0.025 (1)
C14	0.1646 (4)	0.0116 (4)	0.0996 (2)	0.027 (1)
C15	0.1069 (4)	−0.1066 (4)	0.0325 (3)	0.032 (1)
C16	0.1846 (4)	−0.1852 (4)	−0.0044 (3)	0.038 (1)
C17	0.3190 (5)	−0.1465 (5)	0.0247 (3)	0.046 (1)
C18	0.3775 (4)	−0.0295 (4)	0.0922 (3)	0.036 (1)
C19	0.2008 (4)	0.3587 (4)	0.1406 (2)	0.029 (1)
C20	0.1906 (4)	0.4550 (5)	0.0846 (3)	0.040 (1)
C21	0.4868 (3)	0.1804 (4)	0.5669 (2)	0.023 (1)
C22	0.3411 (4)	0.1102 (4)	0.6479 (2)	0.026 (1)
C23	0.2985 (3)	0.0312 (4)	0.4943 (2)	0.024 (1)
C24	0.6146 (3)	0.2664 (4)	0.5652 (2)	0.024 (1)
C25	0.6907 (4)	0.3578 (4)	0.6442 (2)	0.029 (1)
C26	0.8113 (4)	0.4306 (4)	0.6405 (3)	0.032 (1)
C27	0.8525 (4)	0.4069 (4)	0.5584 (3)	0.032 (1)
C28	0.7706 (4)	0.3151 (4)	0.4821 (3)	0.031 (1)
C29	0.3091 (4)	0.1101 (4)	0.7396 (3)	0.028 (1)
C30	0.3818 (4)	0.2063 (4)	0.8176 (3)	0.034 (1)
C31	0.3500 (4)	0.2047 (5)	0.9017 (3)	0.041 (1)
C32	0.2506 (4)	0.1050 (5)	0.9042 (3)	0.041 (1)
C33	0.1847 (4)	0.0125 (5)	0.8233 (3)	0.040 (1)
C34	0.2097 (4)	−0.0535 (4)	0.4076 (2)	0.025 (1)
C35	0.0792 (4)	−0.1105 (4)	0.4060 (3)	0.029 (1)
C36	−0.0004 (4)	−0.1860 (4)	0.3234 (3)	0.034 (1)
C37	0.0522 (4)	−0.2075 (4)	0.2453 (3)	0.033 (1)
C38	0.1839 (4)	−0.1488 (4)	0.2529 (3)	0.031 (1)
H1w1	0.526 (4)	0.144 (4)	0.366 (1)	0.06 (2)*
H1w2	0.421 (3)	0.045 (3)	0.317 (3)	0.04 (1)*
H2	0.4520	0.3989	0.4404	0.035*
H3	0.3520	0.4357	0.5684	0.041*
H4	0.1320	0.3333	0.5546	0.043*
H5	0.0100	0.1942	0.4129	0.043*
H6	0.1095	0.1607	0.2856	0.036*
H8	0.6790	0.1952	0.2583	0.035*
H9	0.8873	0.3050	0.2498	0.041*
H10	0.9184	0.5018	0.2206	0.047*
H11	0.7412	0.5940	0.2027	0.053*
H12	0.5327	0.4886	0.2136	0.044*
H14	0.1106	0.0657	0.1244	0.033*
H15	0.0139	−0.1330	0.0123	0.039*
H16	0.1452	−0.2660	−0.0500	0.045*
H17	0.3724	−0.2003	−0.0016	0.055*
H18	0.4704	−0.0044	0.1124	0.043*
H25	0.6603	0.3703	0.7004	0.035*
H26	0.8644	0.4955	0.6935	0.038*
H27	0.9364	0.4531	0.5540	0.038*
H28	0.8003	0.3003	0.4256	0.038*
H30	0.4521	0.2722	0.8137	0.041*
H31	0.3959	0.2710	0.9563	0.049*
H32	0.2277	0.1001	0.9609	0.049*
H33	0.1164	−0.0561	0.8262	0.048*
H35	0.0455	−0.0976	0.4610	0.034*
H36	−0.0909	−0.2228	0.3203	0.041*
H37	−0.0002	−0.2611	0.1879	0.040*
H38	0.2206	−0.1646	0.1991	0.037*

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
Sn1	0.0210 (1)	0.0277 (2)	0.0201 (1)	0.0036 (1)	0.0055 (1)	0.0092 (1)
F1	0.163 (4)	0.133 (4)	0.135 (3)	0.118 (3)	0.086 (3)	0.095 (3)
F2	0.194 (4)	0.077 (3)	0.036 (2)	0.044 (3)	0.012 (2)	0.026 (2)
F3	0.083 (3)	0.111 (3)	0.201 (5)	−0.025 (2)	−0.036 (3)	0.126 (3)
O1	0.031 (2)	0.045 (2)	0.037 (2)	0.010 (1)	0.006 (1)	0.023 (1)
O2	0.028 (2)	0.047 (2)	0.043 (2)	0.006 (1)	0.005 (1)	0.014 (2)
O1w	0.025 (2)	0.029 (2)	0.024 (2)	0.004 (1)	0.005 (1)	0.013 (1)
N1	0.026 (2)	0.025 (2)	0.024 (2)	0.004 (1)	0.005 (1)	0.011 (1)
N2	0.030 (2)	0.028 (2)	0.025 (2)	0.008 (2)	0.008 (1)	0.011 (1)
N3	0.031 (2)	0.031 (2)	0.025 (2)	0.008 (2)	0.010 (1)	0.013 (1)
N4	0.026 (2)	0.032 (2)	0.024 (2)	0.006 (1)	0.005 (1)	0.013 (1)
N5	0.036 (2)	0.044 (2)	0.032 (2)	0.012 (2)	0.015 (2)	0.019 (2)
N6	0.029 (2)	0.024 (2)	0.024 (2)	0.005 (1)	0.005 (1)	0.010 (1)
C1	0.029 (2)	0.023 (2)	0.022 (2)	0.008 (2)	0.005 (2)	0.009 (2)
C2	0.032 (2)	0.028 (2)	0.029 (2)	0.008 (2)	0.007 (2)	0.011 (2)
C3	0.052 (3)	0.030 (2)	0.022 (2)	0.017 (2)	0.009 (2)	0.006 (2)
C4	0.054 (3)	0.039 (3)	0.031 (2)	0.024 (2)	0.026 (2)	0.020 (2)
C5	0.032 (2)	0.043 (3)	0.041 (3)	0.014 (2)	0.019 (2)	0.021 (2)
C6	0.030 (2)	0.034 (2)	0.025 (2)	0.008 (2)	0.005 (2)	0.009 (2)
C7	0.026 (2)	0.024 (2)	0.018 (2)	0.003 (2)	0.004 (2)	0.005 (2)
C8	0.033 (2)	0.029 (2)	0.031 (2)	0.007 (2)	0.010 (2)	0.016 (2)
C9	0.022 (2)	0.046 (3)	0.039 (2)	0.010 (2)	0.008 (2)	0.016 (2)
C10	0.027 (2)	0.040 (3)	0.047 (3)	−0.003 (2)	0.007 (2)	0.017 (2)
C11	0.033 (2)	0.032 (3)	0.069 (3)	−0.001 (2)	0.004 (2)	0.027 (2)
C12	0.029 (2)	0.029 (2)	0.050 (3)	0.006 (2)	0.004 (2)	0.014 (2)
C13	0.027 (2)	0.032 (2)	0.017 (2)	0.004 (2)	0.006 (2)	0.010 (2)
C14	0.030 (2)	0.033 (2)	0.021 (2)	0.007 (2)	0.007 (2)	0.011 (2)
C15	0.032 (2)	0.036 (3)	0.024 (2)	0.001 (2)	0.000 (2)	0.010 (2)
C16	0.051 (3)	0.032 (3)	0.023 (2)	0.006 (2)	0.001 (2)	0.001 (2)
C17	0.050 (3)	0.047 (3)	0.037 (3	0.020 (2)	0.010 (2)	−0.002 (2)
C18	0.033 (2)	0.046 (3)	0.026 (2)	0.010 (2)	0.008 (2)	0.004 (2)
C19	0.028 (2)	0.032 (2)	0.017 (2)	−0.001 (2)	−0.001 (2)	0.002 (2)
C20	0.036 (2)	0.048 (3)	0.040 (3)	0.014 (2)	0.002 (2)	0.019 (2)
C21	0.028 (2)	0.023 (2)	0.022 (2)	0.009 (2)	0.005 (2)	0.009 (2)
C22	0.034 (2)	0.027 (2)	0.025 (2)	0.015 (2)	0.010 (2)	0.013 (2)
C23	0.028 (2)	0.022 (2)	0.025 (2)	0.008 (2)	0.008 (2)	0.010 (2)
C24	0.024 (2)	0.026 (2)	0.028 (2)	0.011 (2)	0.004 (2)	0.015 (2)
C25	0.034 (2)	0.033 (2)	0.022 (2)	0.008 (2)	0.007 (2)	0.010 (2)
C26	0.028 (2)	0.030 (2)	0.033 (2)	0.003 (2)	−0.002 (2)	0.009 (2)
C27	0.022 (2)	0.036 (3)	0.040 (2)	0.002 (2)	0.003 (2)	0.020 (2)
C28	0.026 (2)	0.045 (3)	0.027 (2)	0.009 (2)	0.007 (2)	0.018 (2)
C29	0.032 (2)	0.035 (2)	0.026 (2)	0.015 (2)	0.011 (2)	0.015 (2)
C30	0.040 (2)	0.040 (3)	0.026 (2)	0.013 (2)	0.011 (2)	0.014 (2)
C31	0.053 (3)	0.049 (3)	0.023 (2)	0.018 (2)	0.010 (2)	0.010 (2)
C32	0.048 (3)	0.063 (3)	0.026 (2)	0.023 (2)	0.018 (2)	0.025 (2)
C33	0.039 (2)	0.056 (3)	0.037 (3)	0.016 (2)	0.018 (2)	0.028 (2)
C34	0.029 (2)	0.022 (2)	0.025 (2)	0.006 (2)	0.005 (2)	0.011 (2)
C35	0.031 (2)	0.028 (2)	0.030 (2)	0.007 (2)	0.009 (2)	0.014 (2)
C36	0.028 (2)	0.033 (2)	0.041 (2)	0.000 (2)	0.002 (2)	0.017 (2)
C37	0.038 (2)	0.028 (2)	0.028 (2)	0.001 (2)	−0.004 (2)	0.012 (2)
C38	0.043 (2)	0.030 (2)	0.022 (2)	0.008 (2)	0.006 (2)	0.013 (2)

Geometric parameters (Å, º)

Sn1—C1	2.132 (4)	C23—C34	1.482 (5)
Sn1—C7	2.135 (3)	C24—C25	1.382 (5)
Sn1—C13	2.118 (4)	C25—C26	1.380 (5)
Sn1—O1	2.217 (3)	C26—C27	1.370 (5)
Sn1—O1w	2.311 (3)	C27—C28	1.380 (5)
F1—C20	1.297 (5)	C29—C30	1.384 (5)
F2—C20	1.292 (5)	C30—C31	1.386 (5)
F3—C20	1.312 (5)	C31—C32	1.373 (6)
O1—C19	1.237 (5)	C32—C33	1.375 (6)
O2—C19	1.215 (4)	C34—C35	1.390 (5)
N1—C21	1.328 (4)	C35—C36	1.377 (5)
N1—C23	1.334 (4)	C36—C37	1.376 (5)
N2—C22	1.338 (5)	C37—C38	1.387 (5)
N2—C21	1.338 (4)	O1w—H1w1	0.85 (1)
N3—C22	1.329 (5)	O1w—H1w2	0.85 (1)
N3—C23	1.341 (4)	C2—H2	0.9500
N4—C28	1.335 (5)	C3—H3	0.9500
N4—C24	1.349 (4)	C4—H4	0.9500
N5—C33	1.340 (5)	C5—H5	0.9500
N5—C29	1.344 (5)	C6—H6	0.9500
N6—C38	1.331 (5)	C8—H8	0.9500
N6—C34	1.351 (4)	C9—H9	0.9500
C1—C2	1.384 (5)	C10—H10	0.9500
C1—C6	1.397 (5)	C11—H11	0.9500
C2—C3	1.395 (5)	C12—H12	0.9500
C3—C4	1.377 (6)	C14—H14	0.9500
C4—C5	1.386 (6)	C15—H15	0.9500
C5—C6	1.383 (5)	C16—H16	0.9500
C7—C12	1.381 (5)	C17—H17	0.9500
C7—C8	1.404 (5)	C18—H18	0.9500
C8—C9	1.387 (5)	C25—H25	0.9500
C9—C10	1.360 (6)	C26—H26	0.9500
C10—C11	1.375 (6)	C27—H27	0.9500
C11—C12	1.386 (5)	C28—H28	0.9500
C13—C14	1.395 (5)	C30—H30	0.9500
C13—C18	1.395 (5)	C31—H31	0.9500
C14—C15	1.392 (5)	C32—H32	0.9500
C15—C16	1.378 (6)	C33—H33	0.9500
C16—C17	1.375 (6)	C35—H35	0.9500
C17—C18	1.389 (6)	C36—H36	0.9500
C19—C20	1.552 (6)	C37—H37	0.9500
C21—C24	1.495 (5)	C38—H38	0.9500
C22—C29	1.497 (5)
C1—Sn1—C13	118.1 (1)	C29—C30—C31	118.6 (4)
C1—Sn1—C7	122.7 (1)	C32—C31—C30	118.5 (4)
C1—Sn1—O1	97.5 (1)	C31—C32—C33	118.9 (4)
C1—Sn1—O1w	88.3 (1)	N5—C33—C32	124.2 (4)
C7—Sn1—C13	118.8 (1)	N6—C34—C35	122.3 (3)
C7—Sn1—O1	86.8 (1)	N6—C34—C23	116.7 (3)
C7—Sn1—O1w	88.4 (1)	C35—C34—C23	121.0 (3)
C13—Sn1—O1	92.6 (1)	C36—C35—C34	118.9 (4)
C13—Sn1—O1w	86.3 (1)	C37—C36—C35	119.4 (4)
O1—Sn1—O1w	173.9 (1)	C36—C37—C38	118.2 (4)
C19—O1—Sn1	129.2 (3)	N6—C38—C37	123.7 (4)
C21—N1—C23	114.9 (3)	Sn1—O1w—H1w1	113 (3)
C22—N2—C21	114.8 (3)	Sn1—O1w—H1w2	105 (3)
C22—N3—C23	114.4 (3)	H1w1—O1w—H1w2	106 (4)
C28—N4—C24	116.5 (3)	C1—C2—H2	119.5
C33—N5—C29	116.1 (4)	C3—C2—H2	119.5
C38—N6—C34	117.5 (3)	C4—C3—H3	120.1
C2—C1—C6	117.9 (3)	C2—C3—H3	120.1
C2—C1—Sn1	120.4 (3)	C3—C4—H4	119.8
C6—C1—Sn1	121.2 (3)	C5—C4—H4	119.8
C1—C2—C3	121.1 (4)	C6—C5—H5	120.4
C4—C3—C2	119.8 (4)	C4—C5—H5	120.4
C3—C4—C5	120.4 (4)	C5—C6—H6	119.1
C6—C5—C4	119.2 (4)	C1—C6—H6	119.1
C5—C6—C1	121.7 (4)	C9—C8—H8	119.8
C12—C7—C8	117.6 (3)	C7—C8—H8	119.8
C12—C7—Sn1	121.5 (3)	C10—C9—H9	119.6
C8—C7—Sn1	120.7 (3)	C8—C9—H9	119.6
C9—C8—C7	120.5 (4)	C9—C10—H10	120.2
C10—C9—C8	120.8 (4)	C11—C10—H10	120.2
C9—C10—C11	119.6 (4)	C10—C11—H11	119.8
C10—C11—C12	120.4 (4)	C12—C11—H11	119.8
C7—C12—C11	121.1 (4)	C7—C12—H12	119.4
C14—C13—C18	118.2 (3)	C11—C12—H12	119.4
C14—C13—Sn1	121.3 (3)	C15—C14—H14	119.6
C18—C13—Sn1	120.5 (3)	C13—C14—H14	119.6
C15—C14—C13	120.9 (4)	C16—C15—H15	120.0
C16—C15—C14	120.0 (4)	C14—C15—H15	120.0
C17—C16—C15	119.9 (4)	C17—C16—H16	120.0
C16—C17—C18	120.6 (4)	C15—C16—H16	120.0
C17—C18—C13	120.5 (4)	C16—C17—H17	119.7
O2—C19—O1	131.3 (4)	C18—C17—H17	119.7
O2—C19—C20	115.8 (4)	C17—C18—H18	119.7
O1—C19—C20	112.9 (3)	C13—C18—H18	119.7
F2—C20—F1	106.1 (4)	C26—C25—H25	120.4
F2—C20—F3	106.4 (4)	C24—C25—H25	120.4
F1—C20—F3	104.1 (5)	C27—C26—H26	120.9
F2—C20—C19	112.4 (4)	C25—C26—H26	120.9
F1—C20—C19	113.5 (4)	C26—C27—H27	120.4
F3—C20—C19	113.6 (3)	C28—C27—H27	120.4
N1—C21—N2	125.1 (3)	N4—C28—H28	118.1
N1—C21—C24	118.3 (3)	C27—C28—H28	118.1
N2—C21—C24	116.6 (3)	C29—C30—H30	120.7
N3—C22—N2	125.3 (3)	C31—C30—H30	120.7
N3—C22—C29	118.7 (3)	C32—C31—H31	120.7
N2—C22—C29	116.0 (3)	C30—C31—H31	120.7
N1—C23—N3	125.3 (3)	C31—C32—H32	120.6
N1—C23—C34	117.1 (3)	C33—C32—H32	120.6
N3—C23—C34	117.6 (3)	N5—C33—H33	117.9
N4—C24—C25	122.9 (3)	C32—C33—H33	117.9
N4—C24—C21	115.9 (3)	C36—C35—H35	120.5
C25—C24—C21	121.1 (3)	C34—C35—H35	120.5
C26—C25—C24	119.3 (3)	C37—C36—H36	120.3
C27—C26—C25	118.3 (4)	C35—C36—H36	120.3
C26—C27—C28	119.2 (4)	C36—C37—H37	120.9
N4—C28—C27	123.7 (4)	C38—C37—H37	120.9
N5—C29—C30	123.6 (3)	N6—C38—H38	118.1
N5—C29—C22	116.7 (3)	C37—C38—H38	118.1
C30—C29—C22	119.6 (4)
C13—Sn1—O1—C19	74.2 (3)	O1—C19—C20—F2	93.0 (5)
C1—Sn1—O1—C19	−44.6 (3)	O2—C19—C20—F1	34.4 (6)
C7—Sn1—O1—C19	−167.2 (3)	O1—C19—C20—F1	−146.6 (4)
C13—Sn1—C1—C2	155.5 (3)	O2—C19—C20—F3	153.1 (4)
C7—Sn1—C1—C2	−16.4 (4)	O1—C19—C20—F3	−27.9 (6)
O1—Sn1—C1—C2	−107.4 (3)	C23—N1—C21—N2	3.6 (6)
O1w—Sn1—C1—C2	70.6 (3)	C23—N1—C21—C24	−176.9 (3)
C13—Sn1—C1—C6	−16.0 (4)	C22—N2—C21—N1	0.4 (6)
C7—Sn1—C1—C6	172.1 (3)	C22—N2—C21—C24	−179.0 (3)
O1—Sn1—C1—C6	81.0 (3)	C23—N3—C22—N2	5.0 (6)
O1w—Sn1—C1—C6	−100.9 (3)	C23—N3—C22—C29	−174.7 (3)
C6—C1—C2—C3	−0.6 (6)	C21—N2—C22—N3	−5.1 (6)
Sn1—C1—C2—C3	−172.4 (3)	C21—N2—C22—C29	174.6 (3)
C1—C2—C3—C4	0.6 (6)	C21—N1—C23—N3	−3.8 (6)
C2—C3—C4—C5	−0.1 (6)	C21—N1—C23—C34	176.1 (3)
C3—C4—C5—C6	−0.4 (6)	C22—N3—C23—N1	−0.2 (6)
C4—C5—C6—C1	0.4 (6)	C22—N3—C23—C34	179.9 (3)
C2—C1—C6—C5	0.1 (6)	C28—N4—C24—C25	2.7 (5)
Sn1—C1—C6—C5	171.8 (3)	C28—N4—C24—C21	−175.0 (3)
C13—Sn1—C7—C12	111.2 (3)	N1—C21—C24—N4	−6.4 (5)
C1—Sn1—C7—C12	−77.0 (3)	N2—C21—C24—N4	173.1 (3)
O1—Sn1—C7—C12	19.9 (3)	N1—C21—C24—C25	175.8 (3)
O1w—Sn1—C7—C12	−163.9 (3)	N2—C21—C24—C25	−4.7 (5)
C13—Sn1—C7—C8	−64.3 (3)	N4—C24—C25—C26	−1.0 (6)
C1—Sn1—C7—C8	107.5 (3)	C21—C24—C25—C26	176.6 (4)
O1—Sn1—C7—C8	−155.6 (3)	C24—C25—C26—C27	−1.6 (6)
O1w—Sn1—C7—C8	20.6 (3)	C25—C26—C27—C28	2.3 (6)
C12—C7—C8—C9	0.5 (6)	C24—N4—C28—C27	−1.9 (6)
Sn1—C7—C8—C9	176.2 (3)	C26—C27—C28—N4	−0.5 (6)
C7—C8—C9—C10	−0.9 (6)	C33—N5—C29—C30	−0.1 (6)
C8—C9—C10—C11	0.7 (6)	C33—N5—C29—C22	178.8 (4)
C9—C10—C11—C12	0.0 (7)	N3—C22—C29—N5	13.2 (5)
C8—C7—C12—C11	0.1 (6)	N2—C22—C29—N5	−166.5 (3)
Sn1—C7—C12—C11	−175.5 (3)	N3—C22—C29—C30	−167.8 (4)
C10—C11—C12—C7	−0.4 (7)	N2—C22—C29—C30	12.5 (5)
C1—Sn1—C13—C14	39.1 (3)	N5—C29—C30—C31	−1.5 (6)
C7—Sn1—C13—C14	−148.7 (3)	C22—C29—C30—C31	179.6 (4)
O1—Sn1—C13—C14	−60.9 (3)	C29—C30—C31—C32	2.2 (6)
O1w—Sn1—C13—C14	125.1 (3)	C30—C31—C32—C33	−1.4 (7)
C1—Sn1—C13—C18	−138.4 (3)	C29—N5—C33—C32	1.1 (6)
C7—Sn1—C13—C18	33.8 (4)	C31—C32—C33—N5	−0.3 (7)
O1—Sn1—C13—C18	121.7 (3)	C38—N6—C34—C35	−1.2 (5)
O1w—Sn1—C13—C18	−52.3 (3)	C38—N6—C34—C23	179.0 (3)
C18—C13—C14—C15	0.7 (5)	N1—C23—C34—N6	11.5 (5)
Sn1—C13—C14—C15	−176.8 (3)	N3—C23—C34—N6	−168.6 (3)
C13—C14—C15—C16	−0.6 (6)	N1—C23—C34—C35	−168.3 (3)
C14—C15—C16—C17	−0.3 (6)	N3—C23—C34—C35	11.6 (5)
C15—C16—C17—C18	1.0 (7)	N6—C34—C35—C36	−1.3 (6)
C16—C17—C18—C13	−0.9 (7)	C23—C34—C35—C36	178.5 (4)
C14—C13—C18—C17	0.0 (6)	C34—C35—C36—C37	2.7 (6)
Sn1—C13—C18—C17	177.5 (3)	C35—C36—C37—C38	−1.7 (6)
Sn1—O1—C19—O2	−2.9 (7)	C34—N6—C38—C37	2.3 (6)
Sn1—O1—C19—C20	178.4 (2)	C36—C37—C38—N6	−0.9 (6)
O2—C19—C20—F2	−85.9 (5)

Hydrogen-bond geometry (Å, º)

D—H···A	D—H	H···A	D···A	D—H···A
O1w—H1w1···N4	0.85 (1)	2.00 (1)	2.841 (4)	170 (4)
O1w—H1w2···N6	0.85 (1)	1.98 (1)	2.826 (4)	174 (4)