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metal-organic compounds
The title compound, [Mn(C26H36N6)](ClO4)2, is isomorphous with its Fe-containing analogue [Al-Obaidi, Jensen, McGarvey, Toftlund, Jensen, Bell & Caroll (1996), Inorg. Chem. 35, 5055–5060].
Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536807012020/hb2327sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536807012020/hb2327Isup2.hkl |
CCDC reference: 643015
Key indicators
- Single-crystal X-ray study
- T = 120 K
- Mean (C-C) = 0.003 Å
- Disorder in solvent or counterion
- R factor = 0.031
- wR factor = 0.036
- Data-to-parameter ratio = 16.8
checkCIF/PLATON results
No syntax errors found
Alert level C PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for Cl2 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for Cl1 PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.65 PLAT302_ALERT_4_C Anion/Solvent Disorder ......................... 33.00 Perc.
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 5 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 ALERT type 2 Indicator that the structure model may be wrong or deficient 0 ALERT type 3 Indicator that the structure quality may be low 3 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check
Computing details top
Data collection: SMART (Siemens, 1995); cell refinement: SAINT (Siemens, 1995); data reduction: SAINT; program(s) used to solve structure: SIR97 (Altomare et al., 1997) and KRYSTAL (Hazell, 1995); program(s) used to refine structure: modified ORFLS (Busing et al., 1962) and KRYSTAL; molecular graphics: ORTEPIII (Burnett & Johnson, 1996) and KRYSTAL; software used to prepare material for publication: KRYSTAL.
(1,1,1-Tris{[N-(2-pyridylmethyl)-N-methylamino]methyl}ethane-
κ6N)manganese(II) bis(perchlorate) top
Crystal data top
[Mn(C26H36N6)](ClO4)2 | F(000) = 1428 |
Mr = 686.45 | Dx = 1.484 Mg m−3 |
Monoclinic, P21/n | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: -P 2yn | Cell parameters from 5800 reflections |
a = 10.3685 (10) Å | θ = 2.0–30.0° |
b = 20.924 (2) Å | µ = 0.66 mm−1 |
c = 14.1957 (14) Å | T = 120 K |
β = 94.064 (2)° | Block, pale yellow |
V = 3072.0 (5) Å3 | 0.34 × 0.28 × 0.24 mm |
Z = 4 |
Data collection top
Siemens SMART CCD area-detector diffractometer | 8956 independent reflections |
Radiation source: x-ray tube | 6851 reflections with I > 3σ(I) |
Graphite monochromator | Rint = 0.036 |
ω scans | θmax = 30.0°, θmin = 2.0° |
Absorption correction: integration (XPREP; Siemens, 1995) | h = −12→14 |
Tmin = 0.739, Tmax = 0.889 | k = −29→29 |
36661 measured reflections | l = −18→19 |
Refinement top
Refinement on F | 0 restraints |
Least-squares matrix: full | 14 constraints |
R[F2 > 2σ(F2)] = 0.031 | H-atom parameters constrained |
wR(F2) = 0.036 | w = 1/{[σcs(F2) + B + (1 + A)2]1/2-|F|}2, where A = 0.03 and B = 0.30 |
S = 1.01 | (Δ/σ)max = 0.001 |
6851 reflections | Δρmax = 0.57 (8) e Å−3 |
408 parameters | Δρmin = −0.67 (8) e Å−3 |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
x | y | z | Uiso*/Ueq | Occ. (<1) | |
Mn1 | 0.48468 (2) | 0.15261 (1) | 0.36524 (2) | 0.0175 (1) | |
N1 | 0.3622 (1) | 0.24088 (6) | 0.37300 (10) | 0.0230 (7) | |
N2 | 0.6343 (1) | 0.23436 (6) | 0.37272 (10) | 0.0242 (7) | |
N3 | 0.5067 (1) | 0.13368 (6) | 0.51825 (9) | 0.0200 (6) | |
N4 | 0.3292 (1) | 0.08267 (6) | 0.32165 (9) | 0.0210 (7) | |
N5 | 0.6564 (1) | 0.08312 (6) | 0.38221 (9) | 0.0199 (6) | |
N6 | 0.4912 (1) | 0.14771 (6) | 0.20548 (9) | 0.0223 (7) | |
C1 | 0.2415 (2) | 0.24490 (8) | 0.4015 (1) | 0.0263 (9) | |
C2 | 0.1857 (2) | 0.30194 (9) | 0.4260 (1) | 0.0325 (10) | |
C3 | 0.2581 (2) | 0.35719 (9) | 0.4226 (1) | 0.0364 (11) | |
C4 | 0.3814 (2) | 0.35392 (8) | 0.3917 (1) | 0.0333 (10) | |
C5 | 0.4304 (2) | 0.29521 (8) | 0.3662 (1) | 0.0251 (8) | |
C6 | 0.5607 (2) | 0.28817 (8) | 0.3276 (1) | 0.0271 (9) | |
C7 | 0.6795 (2) | 0.25788 (8) | 0.4688 (1) | 0.0323 (9) | |
C8 | 0.7477 (2) | 0.21794 (8) | 0.3176 (1) | 0.0276 (9) | |
C9 | 0.7385 (2) | 0.15820 (8) | 0.2535 (1) | 0.0249 (8) | |
C10 | 0.8608 (2) | 0.16080 (10) | 0.1971 (1) | 0.0351 (10) | |
C11 | 0.6251 (2) | 0.15934 (8) | 0.1762 (1) | 0.0266 (8) | |
C12 | 0.3991 (2) | 0.19097 (9) | 0.1517 (1) | 0.0287 (9) | |
C13 | 0.4479 (2) | 0.08159 (8) | 0.1805 (1) | 0.0249 (8) | |
C14 | 0.3285 (2) | 0.06461 (7) | 0.2304 (1) | 0.0218 (8) | |
C15 | 0.2241 (2) | 0.03231 (8) | 0.1858 (1) | 0.0277 (9) | |
C16 | 0.1190 (2) | 0.01746 (8) | 0.2373 (1) | 0.0300 (9) | |
C17 | 0.1209 (2) | 0.03453 (8) | 0.3314 (1) | 0.0269 (9) | |
C18 | 0.2274 (2) | 0.06707 (7) | 0.3708 (1) | 0.0230 (8) | |
C19 | 0.7503 (2) | 0.09457 (8) | 0.3084 (1) | 0.0242 (8) | |
C20 | 0.6194 (2) | 0.01488 (8) | 0.3816 (1) | 0.0251 (8) | |
C21 | 0.7181 (2) | 0.09663 (8) | 0.4772 (1) | 0.0223 (8) | |
C22 | 0.6212 (1) | 0.10849 (7) | 0.5501 (1) | 0.0202 (7) | |
C23 | 0.6506 (2) | 0.09711 (8) | 0.6455 (1) | 0.0242 (8) | |
C24 | 0.5597 (2) | 0.11108 (8) | 0.7093 (1) | 0.0265 (8) | |
C25 | 0.4419 (2) | 0.13679 (8) | 0.6766 (1) | 0.0261 (8) | |
C26 | 0.4201 (2) | 0.14773 (8) | 0.5814 (1) | 0.0235 (8) | |
Cl1 | 0.03884 (4) | 0.14124 (2) | 0.57310 (3) | 0.0235 (2) | |
Cl2 | 0.27765 (7) | 0.0513 (2) | 0.9046 (3) | 0.036 (1) | 0.807 (5) |
Cl2' | 0.2828 (3) | 0.0438 (9) | 0.9063 (13) | 0.036 (1) | 0.193 |
O1 | 0.0001 (1) | 0.16286 (8) | 0.4792 (1) | 0.043 (1) | |
O2 | −0.0696 (1) | 0.14324 (7) | 0.6310 (1) | 0.035 (1) | |
O3 | 0.1394 (1) | 0.18261 (7) | 0.6124 (1) | 0.038 (1) | |
O4 | 0.0863 (1) | 0.07732 (6) | 0.5683 (1) | 0.043 (1) | |
O5 | 0.1843 (4) | 0.0773 (1) | 0.9610 (2) | 0.088 (2) | 0.807 |
O6 | 0.3836 (3) | 0.0958 (2) | 0.9134 (2) | 0.092 (2) | 0.807 |
O7 | 0.3188 (4) | −0.0094 (1) | 0.9448 (3) | 0.076 (2) | 0.807 |
O8 | 0.2322 (5) | 0.0489 (1) | 0.8085 (2) | 0.106 (3) | 0.807 |
O5' | 0.2735 (10) | 0.0922 (4) | 0.9682 (7) | 0.047 (3)* | 0.193 |
O6' | 0.3948 (9) | 0.0519 (5) | 0.8602 (7) | 0.058 (3)* | 0.193 |
O7' | 0.2658 (10) | −0.0164 (6) | 0.9395 (9) | 0.042 (3)* | 0.193 |
O8' | 0.1778 (9) | 0.0470 (5) | 0.8336 (8) | 0.044 (3)* | 0.193 |
H1 | 0.1923 | 0.20677 | 0.4050 | 0.032* | |
H2 | 0.0996 | 0.30314 | 0.4447 | 0.039* | |
H3 | 0.2236 | 0.39692 | 0.4413 | 0.044* | |
H4 | 0.4322 | 0.39152 | 0.3880 | 0.040* | |
H6A | 0.5493 | 0.28062 | 0.2615 | 0.033* | |
H6B | 0.6082 | 0.32657 | 0.3388 | 0.033* | |
H7A | 0.7278 | 0.22527 | 0.5017 | 0.039* | |
H7B | 0.6068 | 0.26881 | 0.5027 | 0.039* | |
H7C | 0.7325 | 0.29451 | 0.4630 | 0.039* | |
H8A | 0.8198 | 0.21197 | 0.3618 | 0.033* | |
H8B | 0.7630 | 0.25356 | 0.2784 | 0.033* | |
H10A | 0.8614 | 0.12510 | 0.1558 | 0.042* | |
H10B | 0.9357 | 0.15975 | 0.2396 | 0.042* | |
H10C | 0.8603 | 0.19914 | 0.1612 | 0.042* | |
H11A | 0.6252 | 0.20026 | 0.1472 | 0.032* | |
H11B | 0.6424 | 0.12752 | 0.1311 | 0.032* | |
H12A | 0.3141 | 0.18359 | 0.1703 | 0.034* | |
H12B | 0.4016 | 0.18282 | 0.0861 | 0.034* | |
H12C | 0.4227 | 0.23414 | 0.1645 | 0.034* | |
H13A | 0.5151 | 0.05237 | 0.1990 | 0.030* | |
H13B | 0.4287 | 0.07891 | 0.1142 | 0.030* | |
H15 | 0.2246 | 0.02058 | 0.1212 | 0.033* | |
H16 | 0.0464 | −0.00428 | 0.2080 | 0.036* | |
H17 | 0.0507 | 0.02414 | 0.3681 | 0.032* | |
H18 | 0.2289 | 0.07895 | 0.4355 | 0.028* | |
H19A | 0.7399 | 0.06090 | 0.2636 | 0.029* | |
H19B | 0.8349 | 0.09283 | 0.3388 | 0.029* | |
H20A | 0.5599 | 0.00753 | 0.4283 | 0.030* | |
H20B | 0.6943 | −0.01063 | 0.3948 | 0.030* | |
H20C | 0.5803 | 0.00389 | 0.3212 | 0.030* | |
H21A | 0.7710 | 0.13349 | 0.4735 | 0.027* | |
H21B | 0.7702 | 0.06107 | 0.4969 | 0.027* | |
H23 | 0.7323 | 0.07992 | 0.6669 | 0.029* | |
H24 | 0.5779 | 0.10312 | 0.7748 | 0.032* | |
H25 | 0.3778 | 0.14662 | 0.7190 | 0.031* | |
H26 | 0.3399 | 0.16614 | 0.5591 | 0.028* |
Atomic displacement parameters (Å2) top
U11 | U22 | U33 | U12 | U13 | U23 | |
Mn1 | 0.0179 (1) | 0.0160 (1) | 0.0181 (1) | −0.0006 (1) | −0.0009 (1) | 0.0023 (1) |
N1 | 0.0261 (7) | 0.0200 (6) | 0.0223 (7) | 0.0015 (5) | −0.0019 (5) | 0.0026 (5) |
N2 | 0.0247 (7) | 0.0197 (6) | 0.0275 (7) | −0.0027 (5) | −0.0033 (6) | 0.0045 (5) |
N3 | 0.0187 (6) | 0.0206 (6) | 0.0205 (7) | 0.0001 (5) | 0.0000 (5) | 0.0010 (5) |
N4 | 0.0215 (7) | 0.0198 (6) | 0.0214 (7) | −0.0001 (5) | 0.0004 (5) | 0.0005 (5) |
N5 | 0.0187 (6) | 0.0208 (6) | 0.0202 (7) | −0.0004 (5) | 0.0025 (5) | 0.0035 (5) |
N6 | 0.0218 (7) | 0.0234 (7) | 0.0214 (7) | −0.0020 (5) | −0.0001 (5) | 0.0048 (5) |
C1 | 0.0275 (9) | 0.0276 (8) | 0.0236 (8) | 0.0038 (7) | 0.0001 (7) | 0.0039 (6) |
C2 | 0.0375 (10) | 0.0360 (10) | 0.0240 (9) | 0.0120 (8) | 0.0029 (7) | 0.0027 (7) |
C3 | 0.0542 (13) | 0.0274 (9) | 0.0275 (10) | 0.0154 (8) | 0.0016 (8) | −0.0016 (7) |
C4 | 0.0481 (11) | 0.0205 (8) | 0.0303 (9) | 0.0024 (8) | −0.0038 (8) | 0.0008 (7) |
C5 | 0.0332 (9) | 0.0201 (7) | 0.0213 (8) | 0.0007 (7) | −0.0041 (7) | 0.0038 (6) |
C6 | 0.0316 (9) | 0.0192 (8) | 0.0299 (9) | −0.0043 (7) | −0.0025 (7) | 0.0058 (6) |
C7 | 0.0378 (10) | 0.0249 (8) | 0.0322 (10) | −0.0063 (7) | −0.0104 (8) | 0.0015 (7) |
C8 | 0.0222 (8) | 0.0257 (8) | 0.0346 (10) | −0.0056 (6) | 0.0001 (7) | 0.0086 (7) |
C9 | 0.0220 (8) | 0.0269 (8) | 0.0262 (8) | −0.0022 (6) | 0.0039 (6) | 0.0076 (7) |
C10 | 0.0271 (9) | 0.0421 (11) | 0.0372 (10) | −0.0024 (8) | 0.0100 (8) | 0.0122 (8) |
C11 | 0.0274 (9) | 0.0290 (9) | 0.0238 (8) | −0.0028 (7) | 0.0044 (7) | 0.0070 (7) |
C12 | 0.0299 (9) | 0.0306 (9) | 0.0250 (9) | 0.0000 (7) | −0.0036 (7) | 0.0078 (7) |
C13 | 0.0282 (9) | 0.0265 (8) | 0.0199 (8) | −0.0021 (7) | 0.0017 (6) | −0.0007 (6) |
C14 | 0.0239 (8) | 0.0191 (7) | 0.0222 (8) | 0.0009 (6) | 0.0005 (6) | 0.0018 (6) |
C15 | 0.0301 (9) | 0.0266 (8) | 0.0254 (9) | −0.0017 (7) | −0.0048 (7) | −0.0016 (6) |
C16 | 0.0238 (9) | 0.0258 (8) | 0.0394 (10) | −0.0020 (7) | −0.0061 (7) | −0.0014 (7) |
C17 | 0.0198 (8) | 0.0230 (8) | 0.0381 (10) | 0.0002 (6) | 0.0031 (7) | 0.0019 (7) |
C18 | 0.0230 (8) | 0.0204 (7) | 0.0259 (8) | 0.0012 (6) | 0.0034 (6) | 0.0006 (6) |
C19 | 0.0214 (8) | 0.0262 (8) | 0.0258 (8) | 0.0016 (6) | 0.0064 (6) | 0.0046 (6) |
C20 | 0.0272 (9) | 0.0201 (8) | 0.0283 (9) | 0.0002 (6) | 0.0049 (7) | 0.0038 (6) |
C21 | 0.0183 (7) | 0.0245 (8) | 0.0238 (8) | 0.0007 (6) | −0.0006 (6) | 0.0053 (6) |
C22 | 0.0190 (7) | 0.0185 (7) | 0.0227 (8) | −0.0017 (6) | −0.0004 (6) | 0.0021 (6) |
C23 | 0.0232 (8) | 0.0247 (8) | 0.0239 (8) | −0.0019 (6) | −0.0048 (6) | 0.0035 (6) |
C24 | 0.0335 (9) | 0.0264 (8) | 0.0191 (8) | −0.0031 (7) | −0.0025 (7) | 0.0006 (6) |
C25 | 0.0305 (9) | 0.0246 (8) | 0.0237 (8) | 0.0004 (7) | 0.0049 (7) | −0.0035 (6) |
C26 | 0.0223 (8) | 0.0227 (8) | 0.0254 (8) | 0.0030 (6) | 0.0015 (6) | 0.0003 (6) |
Cl1 | 0.0189 (2) | 0.0256 (2) | 0.0265 (2) | −0.0020 (1) | 0.0037 (1) | −0.0063 (1) |
Cl2 | 0.0545 (3) | 0.0273 (11) | 0.0262 (3) | 0.0093 (3) | 0.0101 (3) | 0.0043 (7) |
Cl2' | 0.0545 (3) | 0.0273 (11) | 0.0262 (3) | 0.0093 (3) | 0.0101 (3) | 0.0043 (7) |
O1 | 0.027 (1) | 0.062 (1) | 0.039 (1) | −0.006 (1) | −0.002 (1) | 0.015 (1) |
O2 | 0.023 (1) | 0.046 (1) | 0.039 (1) | −0.008 (1) | 0.011 (1) | −0.015 (1) |
O3 | 0.021 (1) | 0.048 (1) | 0.046 (1) | −0.011 (1) | 0.007 (1) | −0.021 (1) |
O4 | 0.052 (1) | 0.029 (1) | 0.050 (1) | 0.007 (1) | 0.019 (1) | −0.003 (1) |
O5 | 0.115 (3) | 0.076 (2) | 0.082 (2) | 0.060 (2) | 0.058 (2) | 0.037 (1) |
O6 | 0.096 (2) | 0.092 (2) | 0.087 (2) | −0.039 (2) | −0.006 (2) | 0.022 (2) |
O7 | 0.086 (2) | 0.040 (1) | 0.106 (2) | 0.034 (2) | 0.039 (2) | 0.030 (1) |
O8 | 0.213 (4) | 0.080 (2) | 0.025 (1) | −0.053 (2) | 0.007 (2) | −0.002 (1) |
Geometric parameters (Å, º) top
Mn1—N1 | 2.249 (1) | Cl2—O5 | 1.408 (4) |
Mn1—N2 | 2.307 (1) | Cl2—O6 | 1.438 (4) |
Mn1—N3 | 2.204 (1) | Cl2—O7 | 1.446 (4) |
Mn1—N4 | 2.232 (1) | Cl2—O8 | 1.412 (5) |
Mn1—N5 | 2.298 (1) | Cl2'—O5' | 1.35 (2) |
Mn1—N6 | 2.276 (1) | Cl2'—O6' | 1.382 (14) |
N1—C1 | 1.345 (2) | Cl2'—O7' | 1.36 (2) |
N1—C5 | 1.346 (2) | Cl2'—O8' | 1.447 (16) |
N2—C6 | 1.481 (2) | C1—H1 | 0.950 |
N2—C7 | 1.494 (2) | C2—H2 | 0.950 |
N2—C8 | 1.497 (2) | C3—H3 | 0.950 |
N3—C26 | 1.346 (2) | C4—H4 | 0.950 |
N3—C22 | 1.347 (2) | C6—H6A | 0.950 |
N4—C18 | 1.346 (2) | C6—H6B | 0.950 |
N4—C14 | 1.349 (2) | C7—H7A | 0.950 |
N5—C21 | 1.478 (2) | C7—H7B | 0.950 |
N5—C20 | 1.479 (2) | C7—H7C | 0.950 |
N5—C19 | 1.499 (2) | C8—H8A | 0.950 |
N6—C12 | 1.487 (2) | C8—H8B | 0.950 |
N6—C13 | 1.490 (2) | C10—H10A | 0.950 |
N6—C11 | 1.497 (2) | C10—H10B | 0.950 |
C1—C2 | 1.381 (2) | C10—H10C | 0.950 |
C2—C3 | 1.381 (3) | C11—H11A | 0.950 |
C3—C4 | 1.383 (3) | C11—H11B | 0.950 |
C4—C5 | 1.387 (2) | C12—H12A | 0.950 |
C5—C6 | 1.500 (3) | C12—H12B | 0.950 |
C8—C9 | 1.545 (2) | C12—H12C | 0.950 |
C9—C19 | 1.543 (2) | C13—H13A | 0.950 |
C9—C10 | 1.548 (2) | C13—H13B | 0.950 |
C9—C11 | 1.550 (2) | C15—H15 | 0.950 |
C13—C14 | 1.512 (2) | C16—H16 | 0.950 |
C14—C15 | 1.390 (2) | C17—H17 | 0.950 |
C15—C16 | 1.389 (3) | C18—H18 | 0.950 |
C16—C17 | 1.381 (3) | C19—H19A | 0.950 |
C17—C18 | 1.381 (2) | C19—H19B | 0.950 |
C21—C22 | 1.513 (2) | C20—H20A | 0.950 |
C22—C23 | 1.388 (2) | C20—H20B | 0.950 |
C23—C24 | 1.384 (2) | C20—H20C | 0.950 |
C24—C25 | 1.384 (2) | C21—H21A | 0.950 |
C25—C26 | 1.374 (2) | C21—H21B | 0.950 |
Cl1—O1 | 1.438 (1) | C23—H23 | 0.950 |
Cl1—O2 | 1.439 (1) | C24—H24 | 0.950 |
Cl1—O3 | 1.437 (1) | C25—H25 | 0.950 |
Cl1—O4 | 1.429 (1) | C26—H26 | 0.950 |
N1—Mn1—N2 | 76.65 (5) | O7—Cl2—O8 | 114.7 (4) |
N1—Mn1—N3 | 96.82 (5) | O5'—Cl2'—O6' | 108.5 (11) |
N1—Mn1—N4 | 98.78 (5) | O5'—Cl2'—O7' | 116.9 (14) |
N1—Mn1—N5 | 161.91 (5) | O5'—Cl2'—O8' | 110.1 (10) |
N1—Mn1—N6 | 98.20 (5) | O6'—Cl2'—O7' | 114.3 (12) |
N2—Mn1—N3 | 93.77 (5) | O6'—Cl2'—O8' | 105.8 (13) |
N2—Mn1—N4 | 165.73 (5) | O7'—Cl2'—O8' | 100.4 (11) |
N2—Mn1—N5 | 87.17 (5) | N1—C1—H1 | 118.5 |
N2—Mn1—N6 | 90.68 (5) | C2—C1—H1 | 118.5 |
N3—Mn1—N4 | 100.23 (5) | C3—C2—H2 | 120.8 |
N3—Mn1—N5 | 75.98 (5) | C1—C2—H2 | 120.8 |
N3—Mn1—N6 | 164.95 (5) | C2—C3—H3 | 120.4 |
N4—Mn1—N5 | 98.83 (5) | C4—C3—H3 | 120.4 |
N4—Mn1—N6 | 76.48 (5) | C3—C4—H4 | 120.3 |
N5—Mn1—N6 | 89.90 (5) | C5—C4—H4 | 120.3 |
Mn1—N1—C1 | 127.4 (1) | H6A—C6—H6B | 109.5 |
Mn1—N1—C5 | 112.9 (1) | N2—C6—H6A | 109.0 |
Mn1—N2—C6 | 102.7 (1) | C5—C6—H6A | 109.0 |
Mn1—N2—C7 | 116.9 (1) | N2—C6—H6B | 109.0 |
Mn1—N2—C8 | 110.9 (1) | C5—C6—H6B | 109.0 |
Mn1—N3—C22 | 115.3 (1) | H7A—C7—H7B | 109.5 |
Mn1—N3—C26 | 126.2 (1) | H7A—C7—H7C | 109.5 |
Mn1—N4—C14 | 113.9 (1) | N2—C7—H7A | 109.5 |
Mn1—N4—C18 | 126.3 (1) | H7B—C7—H7C | 109.5 |
Mn1—N5—C19 | 111.3 (1) | N2—C7—H7B | 109.5 |
Mn1—N5—C20 | 114.3 (1) | N2—C7—H7C | 109.5 |
Mn1—N6—C11 | 111.3 (1) | H8A—C8—H8B | 109.5 |
Mn1—N6—C12 | 114.9 (1) | N2—C8—H8A | 107.2 |
Mn1—N6—C13 | 104.4 (1) | C9—C8—H8A | 107.2 |
C1—N1—C5 | 118.3 (1) | N2—C8—H8B | 107.2 |
C6—N2—C7 | 105.3 (1) | C9—C8—H8B | 107.2 |
C6—N2—C8 | 110.4 (1) | H10A—C10—H10B | 109.5 |
C7—N2—C8 | 110.2 (1) | H10A—C10—H10C | 109.5 |
C22—N3—C26 | 118.4 (1) | C9—C10—H10A | 109.5 |
C14—N4—C18 | 118.6 (1) | H10B—C10—H10C | 109.5 |
C20—N5—C21 | 106.6 (1) | C9—C10—H10B | 109.5 |
C19—N5—C21 | 110.3 (1) | C9—C10—H10C | 109.5 |
C19—N5—C20 | 109.3 (1) | H11A—C11—H11B | 109.5 |
C12—N6—C13 | 105.7 (1) | N6—C11—H11A | 107.2 |
C11—N6—C12 | 109.5 (1) | C9—C11—H11A | 107.2 |
C11—N6—C13 | 110.8 (1) | N6—C11—H11B | 107.2 |
N1—C1—C2 | 123.0 (2) | C9—C11—H11B | 107.2 |
C1—C2—C3 | 118.5 (2) | H12A—C12—H12B | 109.5 |
C2—C3—C4 | 119.1 (2) | H12A—C12—H12C | 109.5 |
C3—C4—C5 | 119.4 (2) | N6—C12—H12A | 109.5 |
N1—C5—C4 | 121.7 (2) | H12B—C12—H12C | 109.5 |
N1—C5—C6 | 115.8 (1) | N6—C12—H12B | 109.5 |
C4—C5—C6 | 122.6 (2) | N6—C12—H12C | 109.5 |
N2—C6—C5 | 111.5 (1) | H13A—C13—H13B | 109.5 |
N2—C8—C9 | 118.4 (1) | N6—C13—H13A | 109.2 |
C8—C9—C19 | 113.6 (1) | C14—C13—H13A | 109.2 |
C10—C9—C19 | 104.6 (1) | N6—C13—H13B | 109.2 |
C11—C9—C19 | 113.6 (1) | C14—C13—H13B | 109.2 |
C8—C9—C10 | 104.9 (1) | C16—C15—H15 | 120.5 |
C8—C9—C11 | 114.6 (1) | C14—C15—H15 | 120.5 |
C10—C9—C11 | 104.0 (1) | C17—C16—H16 | 120.3 |
N6—C11—C9 | 118.2 (1) | C15—C16—H16 | 120.3 |
N6—C13—C14 | 110.5 (1) | C16—C17—H17 | 120.8 |
N4—C14—C15 | 121.6 (2) | C18—C17—H17 | 120.8 |
N4—C14—C13 | 115.8 (1) | N4—C18—H18 | 118.6 |
C13—C14—C15 | 122.6 (2) | C17—C18—H18 | 118.6 |
C14—C15—C16 | 118.9 (2) | H19A—C19—H19B | 109.5 |
C15—C16—C17 | 119.5 (2) | N5—C19—H19A | 107.5 |
C16—C17—C18 | 118.4 (2) | C9—C19—H19A | 107.5 |
N4—C18—C17 | 122.9 (2) | N5—C19—H19B | 107.5 |
N5—C19—C9 | 117.3 (1) | C9—C19—H19B | 107.5 |
N5—C21—C22 | 113.0 (1) | H20A—C20—H20B | 109.5 |
N3—C22—C23 | 121.5 (1) | H20A—C20—H20C | 109.5 |
N3—C22—C21 | 116.6 (1) | N5—C20—H20A | 109.5 |
C21—C22—C23 | 121.9 (1) | H20B—C20—H20C | 109.5 |
C22—C23—C24 | 119.3 (2) | N5—C20—H20B | 109.5 |
C23—C24—C25 | 119.3 (2) | N5—C20—H20C | 109.5 |
C24—C25—C26 | 118.3 (2) | H21A—C21—H21B | 109.5 |
N3—C26—C25 | 123.2 (2) | N5—C21—H21A | 108.6 |
O1—Cl1—O2 | 110.02 (9) | C22—C21—H21A | 108.6 |
O1—Cl1—O3 | 108.54 (9) | N5—C21—H21B | 108.6 |
O1—Cl1—O4 | 108.93 (9) | C22—C21—H21B | 108.6 |
O2—Cl1—O3 | 109.57 (8) | C24—C23—H23 | 120.3 |
O2—Cl1—O4 | 109.89 (9) | C22—C23—H23 | 120.3 |
O3—Cl1—O4 | 109.86 (9) | C23—C24—H24 | 120.4 |
O5—Cl2—O6 | 104.7 (3) | C25—C24—H24 | 120.4 |
O5—Cl2—O7 | 108.0 (3) | C26—C25—H25 | 120.8 |
O5—Cl2—O8 | 111.6 (3) | C24—C25—H25 | 120.8 |
O6—Cl2—O7 | 109.4 (2) | N3—C26—H26 | 118.4 |
O6—Cl2—O8 | 107.9 (3) | C25—C26—H26 | 118.4 |
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