Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806008567/hb2018sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536806008567/hb2018Isup2.hkl |
CCDC reference: 605072
Data collection: SMART (Bruker, 1998); cell refinement: SAINT (Bruker, 1998); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 1998); software used to prepare material for publication: SHELXL97.
[Sn4(C4H9)8(C7H3N2O6)4O2] | Z = 1 |
Mr = 1808.11 | F(000) = 908 |
Triclinic, P1 | Dx = 1.613 Mg m−3 |
Hall symbol: -P 1 | Mo Kα radiation, λ = 0.71073 Å |
a = 10.705 (2) Å | Cell parameters from 3347 reflections |
b = 13.333 (3) Å | θ = 2.4–25.0° |
c = 14.360 (3) Å | µ = 1.41 mm−1 |
α = 68.892 (3)° | T = 298 K |
β = 78.297 (3)° | Block, colourless |
γ = 80.285 (3)° | 0.46 × 0.40 × 0.37 mm |
V = 1862.0 (7) Å3 |
Bruker SMART CCD diffractometer | 6473 independent reflections |
Radiation source: fine-focus sealed tube | 4391 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.028 |
φ and ω scans | θmax = 25.0°, θmin = 1.8° |
Absorption correction: multi-scan (SADABS; Bruker, 1998) | h = −11→12 |
Tmin = 0.564, Tmax = 0.624 | k = −15→15 |
9788 measured reflections | l = −17→16 |
Refinement on F2 | Primary atom site location: structure-invariant direct methods |
Least-squares matrix: full | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.048 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.149 | H-atom parameters constrained |
S = 1.01 | w = 1/[σ2(Fo2) + (0.0672P)2 + 5.5003P] where P = (Fo2 + 2Fc2)/3 |
6473 reflections | (Δ/σ)max = 0.001 |
442 parameters | Δρmax = 1.03 e Å−3 |
1138 restraints | Δρmin = −0.93 e Å−3 |
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. |
x | y | z | Uiso*/Ueq | ||
Sn1 | 0.93792 (5) | 0.25076 (4) | 0.04339 (4) | 0.04818 (19) | |
Sn2 | 0.92654 (5) | 0.49788 (4) | 0.11367 (3) | 0.04630 (18) | |
N1 | 0.4648 (9) | 0.2985 (8) | 0.5355 (7) | 0.088 (2) | |
N2 | 0.6709 (9) | −0.0557 (7) | 0.5353 (7) | 0.085 (2) | |
N3 | 0.9865 (9) | 0.1835 (8) | −0.4806 (6) | 0.0826 (19) | |
N4 | 1.1790 (8) | 0.4945 (7) | −0.4917 (6) | 0.0710 (17) | |
O1 | 0.8861 (5) | 0.2147 (5) | 0.2135 (4) | 0.0627 (12) | |
O2 | 0.7962 (6) | 0.3739 (5) | 0.2242 (4) | 0.0668 (13) | |
O3 | 0.4501 (9) | 0.3920 (7) | 0.4888 (7) | 0.129 (3) | |
O4 | 0.4032 (8) | 0.2553 (7) | 0.6147 (6) | 0.121 (3) | |
O5 | 0.6046 (9) | −0.0935 (6) | 0.6169 (6) | 0.124 (3) | |
O6 | 0.7363 (8) | −0.1084 (6) | 0.4884 (7) | 0.113 (3) | |
O7 | 1.0057 (6) | 0.3101 (5) | −0.1204 (4) | 0.0622 (13) | |
O8 | 0.9585 (7) | 0.1513 (5) | −0.1130 (5) | 0.0769 (14) | |
O9 | 0.9385 (10) | 0.0998 (8) | −0.4292 (6) | 0.120 (3) | |
O10 | 1.0028 (8) | 0.2150 (7) | −0.5709 (5) | 0.105 (2) | |
O11 | 1.1965 (7) | 0.5212 (6) | −0.5821 (5) | 0.093 (2) | |
O12 | 1.2025 (7) | 0.5468 (6) | −0.4452 (5) | 0.0877 (19) | |
O13 | 0.9660 (5) | 0.4039 (4) | 0.0229 (4) | 0.0514 (11) | |
C1 | 0.8096 (8) | 0.2698 (7) | 0.2576 (6) | 0.0533 (14) | |
C2 | 0.7299 (8) | 0.2188 (7) | 0.3568 (6) | 0.0580 (16) | |
C3 | 0.6418 (8) | 0.2824 (7) | 0.4015 (6) | 0.0633 (17) | |
H3 | 0.6338 | 0.3573 | 0.3725 | 0.076* | |
C4 | 0.5657 (8) | 0.2310 (7) | 0.4908 (6) | 0.0652 (18) | |
C5 | 0.5751 (9) | 0.1230 (8) | 0.5372 (7) | 0.0739 (19) | |
H5 | 0.5240 | 0.0909 | 0.5982 | 0.089* | |
C6 | 0.6645 (9) | 0.0621 (7) | 0.4896 (7) | 0.0674 (18) | |
C7 | 0.7422 (8) | 0.1086 (7) | 0.4007 (6) | 0.0613 (17) | |
H7 | 0.8023 | 0.0659 | 0.3706 | 0.074* | |
C8 | 0.9950 (9) | 0.2405 (8) | −0.1609 (6) | 0.0644 (16) | |
C9 | 1.0310 (9) | 0.2752 (7) | −0.2752 (6) | 0.0632 (16) | |
C10 | 0.9972 (9) | 0.2138 (8) | −0.3238 (7) | 0.0697 (17) | |
H10 | 0.9572 | 0.1514 | −0.2876 | 0.084* | |
C11 | 1.0245 (9) | 0.2477 (8) | −0.4273 (6) | 0.0662 (17) | |
C12 | 1.0860 (9) | 0.3363 (8) | −0.4838 (7) | 0.0671 (17) | |
H12 | 1.1047 | 0.3568 | −0.5538 | 0.080* | |
C13 | 1.1190 (9) | 0.3937 (7) | −0.4318 (6) | 0.0635 (17) | |
C14 | 1.0917 (8) | 0.3650 (7) | −0.3300 (6) | 0.0614 (16) | |
H14 | 1.1144 | 0.4067 | −0.2975 | 0.074* | |
C15 | 1.1005 (9) | 0.1362 (8) | 0.0739 (7) | 0.0800 (19) | |
H15A | 1.0740 | 0.0648 | 0.0908 | 0.096* | |
H15B | 1.1622 | 0.1492 | 0.0123 | 0.096* | |
C16 | 1.1663 (10) | 0.1345 (10) | 0.1548 (8) | 0.101 (2) | |
H16A | 1.1133 | 0.1032 | 0.2193 | 0.121* | |
H16B | 1.1744 | 0.2084 | 0.1476 | 0.121* | |
C17 | 1.3020 (12) | 0.0700 (11) | 0.1564 (11) | 0.139 (4) | |
H17A | 1.3499 | 0.0906 | 0.0886 | 0.166* | |
H17B | 1.3477 | 0.0885 | 0.1988 | 0.166* | |
C18 | 1.2949 (16) | −0.0400 (11) | 0.1924 (13) | 0.170 (6) | |
H18A | 1.3800 | −0.0771 | 0.1912 | 0.255* | |
H18B | 1.2496 | −0.0585 | 0.1506 | 0.255* | |
H18C | 1.2503 | −0.0611 | 0.2605 | 0.255* | |
C19 | 0.7423 (8) | 0.2508 (7) | 0.0366 (7) | 0.0659 (15) | |
H19A | 0.6947 | 0.3131 | 0.0519 | 0.079* | |
H19B | 0.7347 | 0.2604 | −0.0323 | 0.079* | |
C20 | 0.6794 (10) | 0.1529 (7) | 0.1048 (9) | 0.095 (2) | |
H20A | 0.6527 | 0.1619 | 0.1703 | 0.113* | |
H20B | 0.6018 | 0.1542 | 0.0792 | 0.113* | |
C21 | 0.7449 (11) | 0.0473 (8) | 0.1220 (9) | 0.101 (3) | |
H21A | 0.8207 | 0.0461 | 0.1498 | 0.121* | |
H21B | 0.7752 | 0.0405 | 0.0559 | 0.121* | |
C22 | 0.6869 (13) | −0.0523 (9) | 0.1850 (12) | 0.139 (5) | |
H22A | 0.7493 | −0.1135 | 0.1865 | 0.209* | |
H22B | 0.6149 | −0.0576 | 0.1572 | 0.209* | |
H22C | 0.6587 | −0.0508 | 0.2524 | 0.209* | |
C23 | 1.0653 (7) | 0.4341 (7) | 0.2125 (6) | 0.0616 (17) | |
H23A | 1.0496 | 0.4732 | 0.2599 | 0.074* | |
H23B | 1.0520 | 0.3593 | 0.2513 | 0.074* | |
C24 | 1.2005 (8) | 0.4381 (8) | 0.1653 (7) | 0.079 (2) | |
H24A | 1.2182 | 0.5131 | 0.1378 | 0.095* | |
H24B | 1.2124 | 0.4116 | 0.1090 | 0.095* | |
C25 | 1.2977 (8) | 0.3749 (9) | 0.2327 (7) | 0.087 (3) | |
H25A | 1.2971 | 0.4090 | 0.2822 | 0.104* | |
H25B | 1.2728 | 0.3026 | 0.2690 | 0.104* | |
C26 | 1.4307 (10) | 0.3669 (12) | 0.1772 (10) | 0.127 (4) | |
H26A | 1.4878 | 0.3249 | 0.2242 | 0.191* | |
H26B | 1.4575 | 0.4380 | 0.1432 | 0.191* | |
H26C | 1.4325 | 0.3325 | 0.1285 | 0.191* | |
C27 | 0.7487 (8) | 0.5954 (7) | 0.0920 (6) | 0.067 (2) | |
H27A | 0.7686 | 0.6667 | 0.0464 | 0.080* | |
H27B | 0.7045 | 0.5659 | 0.0566 | 0.080* | |
C28 | 0.6551 (8) | 0.6110 (9) | 0.1786 (7) | 0.083 (2) | |
H28A | 0.6940 | 0.6472 | 0.2114 | 0.100* | |
H28B | 0.6368 | 0.5406 | 0.2272 | 0.100* | |
C29 | 0.5288 (9) | 0.6764 (9) | 0.1496 (8) | 0.095 (3) | |
H29A | 0.5456 | 0.7503 | 0.1102 | 0.114* | |
H29B | 0.4980 | 0.6474 | 0.1064 | 0.114* | |
C30 | 0.4270 (12) | 0.6779 (13) | 0.2338 (11) | 0.158 (6) | |
H30A | 0.3515 | 0.7199 | 0.2083 | 0.237* | |
H30B | 0.4545 | 0.7095 | 0.2757 | 0.237* | |
H30C | 0.4081 | 0.6053 | 0.2730 | 0.237* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Sn1 | 0.0516 (3) | 0.0487 (3) | 0.0374 (3) | −0.0035 (2) | 0.0026 (2) | −0.0122 (2) |
Sn2 | 0.0478 (3) | 0.0512 (3) | 0.0318 (3) | −0.0015 (2) | 0.0041 (2) | −0.0116 (2) |
N1 | 0.082 (4) | 0.083 (4) | 0.071 (4) | −0.004 (3) | 0.021 (3) | −0.011 (3) |
N2 | 0.084 (4) | 0.072 (4) | 0.073 (4) | −0.010 (3) | 0.010 (3) | −0.006 (3) |
N3 | 0.099 (4) | 0.093 (4) | 0.059 (3) | −0.022 (3) | −0.008 (3) | −0.026 (3) |
N4 | 0.080 (4) | 0.077 (4) | 0.049 (3) | −0.004 (3) | 0.002 (3) | −0.022 (3) |
O1 | 0.063 (2) | 0.068 (2) | 0.048 (2) | −0.001 (2) | 0.006 (2) | −0.019 (2) |
O2 | 0.065 (2) | 0.063 (2) | 0.054 (2) | −0.006 (2) | 0.015 (2) | −0.012 (2) |
O3 | 0.125 (5) | 0.103 (5) | 0.113 (5) | 0.018 (4) | 0.035 (4) | −0.025 (4) |
O4 | 0.113 (5) | 0.115 (5) | 0.091 (5) | −0.003 (4) | 0.055 (4) | −0.025 (4) |
O5 | 0.140 (6) | 0.083 (5) | 0.096 (5) | −0.017 (4) | 0.027 (5) | 0.012 (4) |
O6 | 0.118 (5) | 0.068 (4) | 0.113 (5) | −0.005 (4) | 0.027 (5) | −0.008 (4) |
O7 | 0.076 (3) | 0.065 (3) | 0.042 (2) | −0.006 (2) | 0.003 (2) | −0.021 (2) |
O8 | 0.092 (3) | 0.077 (3) | 0.056 (3) | −0.015 (3) | 0.002 (2) | −0.019 (2) |
O9 | 0.161 (6) | 0.133 (6) | 0.084 (5) | −0.065 (5) | −0.010 (5) | −0.040 (4) |
O10 | 0.139 (6) | 0.130 (5) | 0.060 (4) | −0.038 (5) | −0.017 (4) | −0.036 (4) |
O11 | 0.110 (5) | 0.098 (5) | 0.052 (4) | −0.019 (4) | 0.010 (3) | −0.010 (3) |
O12 | 0.108 (5) | 0.085 (4) | 0.067 (4) | −0.018 (4) | −0.001 (4) | −0.025 (3) |
O13 | 0.055 (2) | 0.054 (2) | 0.041 (2) | −0.006 (2) | 0.0008 (19) | −0.0168 (19) |
C1 | 0.054 (3) | 0.058 (3) | 0.043 (3) | 0.001 (2) | −0.001 (2) | −0.018 (2) |
C2 | 0.060 (3) | 0.061 (3) | 0.046 (3) | −0.008 (3) | 0.004 (3) | −0.014 (3) |
C3 | 0.064 (3) | 0.062 (3) | 0.052 (3) | −0.004 (3) | 0.008 (3) | −0.015 (3) |
C4 | 0.065 (3) | 0.067 (3) | 0.052 (3) | −0.003 (3) | 0.010 (3) | −0.018 (3) |
C5 | 0.073 (3) | 0.070 (3) | 0.060 (3) | −0.009 (3) | 0.010 (3) | −0.010 (3) |
C6 | 0.068 (3) | 0.062 (3) | 0.057 (3) | −0.007 (3) | 0.005 (3) | −0.010 (3) |
C7 | 0.062 (3) | 0.060 (3) | 0.052 (3) | −0.005 (3) | 0.005 (3) | −0.015 (3) |
C8 | 0.076 (3) | 0.069 (3) | 0.047 (3) | −0.008 (3) | −0.001 (3) | −0.021 (3) |
C9 | 0.075 (3) | 0.074 (3) | 0.043 (3) | −0.007 (3) | −0.005 (3) | −0.026 (3) |
C10 | 0.079 (3) | 0.078 (3) | 0.051 (3) | −0.012 (3) | −0.001 (3) | −0.023 (3) |
C11 | 0.079 (3) | 0.079 (3) | 0.047 (3) | −0.009 (3) | −0.008 (3) | −0.028 (3) |
C12 | 0.077 (3) | 0.080 (3) | 0.046 (3) | −0.007 (3) | −0.002 (3) | −0.027 (3) |
C13 | 0.071 (3) | 0.071 (3) | 0.047 (3) | −0.006 (3) | −0.001 (3) | −0.023 (3) |
C14 | 0.070 (3) | 0.069 (3) | 0.047 (3) | −0.005 (3) | −0.003 (3) | −0.026 (3) |
C15 | 0.078 (3) | 0.077 (3) | 0.065 (3) | 0.009 (3) | 0.001 (3) | −0.015 (3) |
C16 | 0.094 (5) | 0.114 (5) | 0.078 (4) | 0.015 (4) | −0.016 (4) | −0.022 (4) |
C17 | 0.124 (6) | 0.137 (7) | 0.115 (6) | 0.020 (6) | −0.020 (6) | −0.009 (6) |
C18 | 0.159 (10) | 0.146 (10) | 0.164 (10) | −0.009 (9) | −0.008 (9) | −0.015 (9) |
C19 | 0.0573 (17) | 0.070 (3) | 0.061 (3) | −0.011 (3) | −0.005 (3) | −0.012 (3) |
C20 | 0.076 (4) | 0.088 (4) | 0.095 (4) | −0.012 (4) | −0.003 (4) | −0.006 (4) |
C21 | 0.089 (4) | 0.086 (4) | 0.098 (4) | −0.012 (4) | 0.005 (4) | −0.005 (4) |
C22 | 0.103 (8) | 0.106 (8) | 0.162 (10) | −0.030 (7) | 0.014 (8) | 0.000 (8) |
C23 | 0.062 (3) | 0.069 (3) | 0.047 (3) | 0.002 (3) | −0.006 (3) | −0.017 (3) |
C24 | 0.072 (4) | 0.091 (4) | 0.060 (4) | 0.001 (4) | −0.011 (4) | −0.011 (4) |
C25 | 0.076 (5) | 0.102 (6) | 0.070 (5) | 0.012 (5) | −0.014 (4) | −0.022 (4) |
C26 | 0.091 (8) | 0.168 (10) | 0.109 (8) | 0.014 (8) | −0.021 (7) | −0.039 (8) |
C27 | 0.056 (4) | 0.068 (4) | 0.057 (4) | 0.004 (3) | 0.006 (3) | −0.012 (3) |
C28 | 0.072 (4) | 0.088 (4) | 0.071 (4) | 0.009 (4) | 0.003 (4) | −0.020 (4) |
C29 | 0.070 (5) | 0.099 (6) | 0.093 (6) | 0.011 (5) | 0.001 (5) | −0.021 (5) |
C30 | 0.099 (9) | 0.174 (11) | 0.147 (10) | 0.027 (8) | 0.017 (8) | −0.028 (9) |
Sn1—O13 | 2.021 (5) | C15—C16 | 1.467 (12) |
Sn1—C19 | 2.116 (8) | C15—H15A | 0.9700 |
Sn1—C15 | 2.118 (9) | C15—H15B | 0.9700 |
Sn1—O7 | 2.202 (5) | C16—C17 | 1.558 (13) |
Sn1—O1 | 2.281 (5) | C16—H16A | 0.9700 |
Sn1—O8 | 2.949 (6) | C16—H16B | 0.9700 |
Sn2—O13 | 2.055 (5) | C17—C18 | 1.379 (14) |
Sn2—C23 | 2.123 (8) | C17—H17A | 0.9700 |
Sn2—C27 | 2.127 (8) | C17—H17B | 0.9700 |
Sn2—O13i | 2.151 (5) | C18—H18A | 0.9600 |
Sn2—O2 | 2.277 (5) | C18—H18B | 0.9600 |
Sn2—O7i | 2.815 (6) | C18—H18C | 0.9600 |
N1—O3 | 1.183 (10) | C19—C20 | 1.491 (11) |
N1—O4 | 1.189 (10) | C19—H19A | 0.9700 |
N1—C4 | 1.481 (12) | C19—H19B | 0.9700 |
N2—O6 | 1.193 (10) | C20—C21 | 1.423 (12) |
N2—O5 | 1.220 (10) | C20—H20A | 0.9700 |
N2—C6 | 1.463 (12) | C20—H20B | 0.9700 |
N3—O10 | 1.195 (10) | C21—C22 | 1.466 (12) |
N3—O9 | 1.226 (11) | C21—H21A | 0.9700 |
N3—C11 | 1.483 (12) | C21—H21B | 0.9700 |
N4—O11 | 1.199 (9) | C22—H22A | 0.9600 |
N4—O12 | 1.208 (9) | C22—H22B | 0.9600 |
N4—C13 | 1.481 (12) | C22—H22C | 0.9600 |
C1—O1 | 1.238 (9) | C23—C24 | 1.469 (10) |
C1—O2 | 1.288 (9) | C23—H23A | 0.9700 |
C8—O7 | 1.290 (10) | C23—H23B | 0.9700 |
C8—O8 | 1.224 (10) | C24—C25 | 1.502 (11) |
O13—Sn2i | 2.151 (5) | C24—H24A | 0.9700 |
C1—C2 | 1.491 (11) | C24—H24B | 0.9700 |
C2—C7 | 1.369 (11) | C25—C26 | 1.491 (12) |
C2—C3 | 1.378 (11) | C25—H25A | 0.9700 |
C3—C4 | 1.382 (11) | C25—H25B | 0.9700 |
C3—H3 | 0.9300 | C26—H26A | 0.9600 |
C4—C5 | 1.348 (12) | C26—H26B | 0.9600 |
C5—C6 | 1.383 (12) | C26—H26C | 0.9600 |
C5—H5 | 0.9300 | C27—C28 | 1.484 (10) |
C6—C7 | 1.371 (11) | C27—H27A | 0.9700 |
C7—H7 | 0.9300 | C27—H27B | 0.9700 |
C8—C9 | 1.520 (11) | C28—C29 | 1.527 (11) |
C9—C14 | 1.362 (12) | C28—H28A | 0.9700 |
C9—C10 | 1.379 (12) | C28—H28B | 0.9700 |
C10—C11 | 1.372 (12) | C29—C30 | 1.458 (12) |
C10—H10 | 0.9300 | C29—H29A | 0.9700 |
C11—C12 | 1.357 (12) | C29—H29B | 0.9700 |
C12—C13 | 1.371 (12) | C30—H30A | 0.9600 |
C12—H12 | 0.9300 | C30—H30B | 0.9600 |
C13—C14 | 1.353 (11) | C30—H30C | 0.9600 |
C14—H14 | 0.9300 | ||
O13—Sn1—C19 | 107.3 (3) | C16—C15—H15B | 108.0 |
O13—Sn1—C15 | 114.8 (3) | Sn1—C15—H15B | 108.0 |
C19—Sn1—C15 | 137.7 (4) | H15A—C15—H15B | 107.3 |
O13—Sn1—O7 | 79.4 (2) | C15—C16—C17 | 114.5 (9) |
C19—Sn1—O7 | 97.6 (3) | C15—C16—H16A | 108.6 |
C15—Sn1—O7 | 93.4 (3) | C17—C16—H16A | 108.6 |
O13—Sn1—O1 | 90.7 (2) | C15—C16—H16B | 108.6 |
C19—Sn1—O1 | 89.0 (3) | C17—C16—H16B | 108.6 |
C15—Sn1—O1 | 87.2 (3) | H16A—C16—H16B | 107.6 |
O7—Sn1—O1 | 169.4 (2) | C18—C17—C16 | 111.7 (12) |
O13—Sn1—O8 | 127.56 (18) | C18—C17—H17A | 109.3 |
C19—Sn1—O8 | 78.7 (3) | C16—C17—H17A | 109.3 |
C15—Sn1—O8 | 78.6 (3) | C18—C17—H17B | 109.3 |
O7—Sn1—O8 | 48.44 (19) | C16—C17—H17B | 109.3 |
O1—Sn1—O8 | 141.73 (19) | H17A—C17—H17B | 107.9 |
O13—Sn2—C23 | 103.9 (3) | C17—C18—H18A | 109.5 |
O13—Sn2—C27 | 110.4 (3) | C17—C18—H18B | 109.5 |
C23—Sn2—C27 | 144.1 (3) | H18A—C18—H18B | 109.5 |
O13—Sn2—O13i | 76.3 (2) | C17—C18—H18C | 109.5 |
C23—Sn2—O13i | 102.8 (3) | H18A—C18—H18C | 109.5 |
C27—Sn2—O13i | 95.4 (3) | H18B—C18—H18C | 109.5 |
O13—Sn2—O2 | 88.1 (2) | C20—C19—Sn1 | 116.7 (6) |
C23—Sn2—O2 | 88.6 (3) | C20—C19—H19A | 108.1 |
C27—Sn2—O2 | 82.4 (3) | Sn1—C19—H19A | 108.1 |
O13i—Sn2—O2 | 162.4 (2) | C20—C19—H19B | 108.1 |
O13—Sn2—O7i | 139.97 (18) | Sn1—C19—H19B | 108.1 |
C23—Sn2—O7i | 79.4 (3) | H19A—C19—H19B | 107.3 |
C27—Sn2—O7i | 81.1 (3) | C21—C20—C19 | 121.4 (9) |
O13i—Sn2—O7i | 64.31 (17) | C21—C20—H20A | 107.0 |
O2—Sn2—O7i | 131.91 (18) | C19—C20—H20A | 107.0 |
O3—N1—O4 | 124.5 (10) | C21—C20—H20B | 107.0 |
O3—N1—C4 | 117.4 (8) | C19—C20—H20B | 107.0 |
O4—N1—C4 | 118.0 (9) | H20A—C20—H20B | 106.7 |
O6—N2—O5 | 124.2 (9) | C20—C21—C22 | 124.1 (10) |
O6—N2—C6 | 117.9 (8) | C20—C21—H21A | 106.3 |
O5—N2—C6 | 117.9 (9) | C22—C21—H21A | 106.3 |
O10—N3—O9 | 122.7 (9) | C20—C21—H21B | 106.3 |
O10—N3—C11 | 119.5 (9) | C22—C21—H21B | 106.3 |
O9—N3—C11 | 117.8 (8) | H21A—C21—H21B | 106.4 |
O11—N4—O12 | 124.3 (9) | C21—C22—H22A | 109.5 |
O11—N4—C13 | 118.9 (8) | C21—C22—H22B | 109.5 |
O12—N4—C13 | 116.8 (7) | H22A—C22—H22B | 109.5 |
C1—O1—Sn1 | 127.2 (5) | C21—C22—H22C | 109.5 |
C1—O2—Sn2 | 132.3 (5) | H22A—C22—H22C | 109.5 |
C8—O7—Sn1 | 110.8 (5) | H22B—C22—H22C | 109.5 |
C8—O8—Sn1 | 76.7 (5) | C24—C23—Sn2 | 116.5 (6) |
Sn1—O13—Sn2 | 134.2 (3) | C24—C23—H23A | 108.2 |
Sn1—O13—Sn2i | 121.8 (2) | Sn2—C23—H23A | 108.2 |
Sn2—O13—Sn2i | 103.7 (2) | C24—C23—H23B | 108.2 |
O1—C1—O2 | 123.2 (7) | Sn2—C23—H23B | 108.2 |
O1—C1—C2 | 121.5 (7) | H23A—C23—H23B | 107.3 |
O2—C1—C2 | 115.2 (7) | C23—C24—C25 | 116.2 (8) |
C7—C2—C3 | 120.7 (8) | C23—C24—H24A | 108.2 |
C7—C2—C1 | 119.4 (7) | C25—C24—H24A | 108.2 |
C3—C2—C1 | 119.8 (8) | C23—C24—H24B | 108.2 |
C2—C3—C4 | 117.7 (8) | C25—C24—H24B | 108.2 |
C2—C3—H3 | 121.1 | H24A—C24—H24B | 107.4 |
C4—C3—H3 | 121.1 | C26—C25—C24 | 113.5 (9) |
C5—C4—C3 | 123.6 (8) | C26—C25—H25A | 108.9 |
C5—C4—N1 | 118.4 (8) | C24—C25—H25A | 108.9 |
C3—C4—N1 | 117.9 (8) | C26—C25—H25B | 108.9 |
C4—C5—C6 | 116.8 (8) | C24—C25—H25B | 108.9 |
C4—C5—H5 | 121.6 | H25A—C25—H25B | 107.7 |
C6—C5—H5 | 121.6 | C25—C26—H26A | 109.5 |
C7—C6—C5 | 122.2 (9) | C25—C26—H26B | 109.5 |
C7—C6—N2 | 120.1 (8) | H26A—C26—H26B | 109.5 |
C5—C6—N2 | 117.7 (8) | C25—C26—H26C | 109.5 |
C2—C7—C6 | 119.0 (8) | H26A—C26—H26C | 109.5 |
C2—C7—H7 | 120.5 | H26B—C26—H26C | 109.5 |
C6—C7—H7 | 120.5 | C28—C27—Sn2 | 121.5 (6) |
O8—C8—O7 | 124.0 (8) | C28—C27—H27A | 107.0 |
O8—C8—C9 | 120.2 (8) | Sn2—C27—H27A | 107.0 |
O7—C8—C9 | 115.8 (8) | C28—C27—H27B | 107.0 |
C14—C9—C10 | 119.7 (8) | Sn2—C27—H27B | 107.0 |
C14—C9—C8 | 122.4 (8) | H27A—C27—H27B | 106.7 |
C10—C9—C8 | 117.9 (8) | C27—C28—C29 | 114.2 (8) |
C11—C10—C9 | 118.0 (9) | C27—C28—H28A | 108.7 |
C11—C10—H10 | 121.0 | C29—C28—H28A | 108.7 |
C9—C10—H10 | 121.0 | C27—C28—H28B | 108.7 |
C12—C11—C10 | 123.5 (9) | C29—C28—H28B | 108.7 |
C12—C11—N3 | 118.0 (8) | H28A—C28—H28B | 107.6 |
C10—C11—N3 | 118.5 (9) | C30—C29—C28 | 115.5 (10) |
C11—C12—C13 | 116.2 (8) | C30—C29—H29A | 108.4 |
C11—C12—H12 | 121.9 | C28—C29—H29A | 108.4 |
C13—C12—H12 | 121.9 | C30—C29—H29B | 108.4 |
C14—C13—C12 | 122.5 (9) | C28—C29—H29B | 108.4 |
C14—C13—N4 | 120.0 (8) | H29A—C29—H29B | 107.5 |
C12—C13—N4 | 117.4 (8) | C29—C30—H30A | 109.5 |
C13—C14—C9 | 120.0 (8) | C29—C30—H30B | 109.5 |
C13—C14—H14 | 120.0 | H30A—C30—H30B | 109.5 |
C9—C14—H14 | 120.0 | C29—C30—H30C | 109.5 |
C16—C15—Sn1 | 117.0 (7) | H30A—C30—H30C | 109.5 |
C16—C15—H15A | 108.0 | H30B—C30—H30C | 109.5 |
Sn1—C15—H15A | 108.0 |
Symmetry code: (i) −x+2, −y+1, −z. |