(1,1,1-Tris{[N-(2-pyridylmeth­yl)-N-methylamino]meth­yl}ethane-κ⁶N)manganese(II) bis­(perchlorate)

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].

Key indicators

• Single-crystal X-ray study
• T = 120 K
• Mean [sigma](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

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Computing details

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)

Crystal data

[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) Å^3	0.34 × 0.28 × 0.24 mm
Z = 4

Data collection

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

Refinement on F	0 restraints
Least-squares matrix: full	14 constraints
R[F^2 > 2σ(F^2)] = 0.031	H-atom parameters constrained
wR(F^2) = 0.036	w = 1/{[σcs(F^2) + 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

Special details

Refinement. Sfls: F calc weight full matrix

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

	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 (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
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)

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