| Literature DB >> 21577436 |
Ting-Hong Huang1, Xuan-Feng Jiang, Liu-Cheng Gui, Xiu-Jian Wang, Zhong-Min Cen.
Abstract
In the centrosymmetric dinuclear title compound, [Cu(2)(C(2)H(3)N)(2)(C(18)H(10)N(4))(2)(C(32)H(30)N(2)P(2))](BF(4))(2), the Cu(I) centre is coordinated by two N atoms from a dipyridophenazine ligand, one P atom from an N,N'-bis-[(diphenyl-phosphan-yl)meth-yl]benzene-1,4-diamine (bpbda) ligand, and one N atom from an acetonitrile mol-ecule in a distorted tetra-hedral geometry. The bpbda ligand, lying on an inversion center, bridges two Cu(I) centres into a Z-shaped complex. Intra-molecular π-π inter-actions between the dipyridophenazine ligand and the benzene ring of the bpbda ligand are observed [centroid-centroid distance = 3.459 (3) Å]. The crystal structure also involves inter-molecular π-π inter-actions between the dipyridophenazine ligands [centroid-centroid distance = 3.506 (3) Å], which lead to a one-dimensional supra-molecular structure.Entities:
Year: 2009 PMID: 21577436 PMCID: PMC2970105 DOI: 10.1107/S1600536809031754
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Cu2(C2H3N)2(C18H10N4)2(C32H30N2P2)](BF4)2 | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 12749 reflections | |
| θ = 2.6–27.5° | |
| µ = 0.79 mm−1 | |
| α = 84.905 (1)° | |
| β = 68.250 (1)° | Block, red |
| γ = 66.732 (1)° | 0.32 × 0.24 × 0.20 mm |
| Rigaku Mercury CCD diffractometer | 7288 independent reflections |
| Radiation source: fine-focus sealed tube | 6153 reflections with |
| graphite | |
| ω scans | θmax = 27.5°, θmin = 3.1° |
| Absorption correction: multi-scan ( | |
| 15862 measured reflections |
| Refinement on | Primary atom site location: structure-invariant direct methods |
| Least-squares matrix: full | Secondary atom site location: difference Fourier map |
| Hydrogen site location: inferred from neighbouring sites | |
| H-atom parameters constrained | |
| 7288 reflections | (Δ/σ)max = 0.001 |
| 443 parameters | Δρmax = 0.80 e Å−3 |
| 0 restraints | Δρmin = −0.58 e Å−3 |
| Cu1 | 0.10933 (3) | 0.22834 (2) | 0.22835 (2) | 0.02592 (10) | |
| P2 | −0.08284 (5) | 0.22819 (5) | 0.26979 (4) | 0.02005 (12) | |
| N1 | −0.17869 (19) | 0.45511 (16) | 0.19707 (16) | 0.0271 (4) | |
| H1A | −0.2264 | 0.5113 | 0.2499 | 0.033* | |
| N2 | 0.09991 (17) | 0.39591 (17) | 0.25741 (15) | 0.0243 (4) | |
| N3 | 0.24317 (17) | 0.24169 (16) | 0.07427 (16) | 0.0235 (4) | |
| N4 | 0.28443 (17) | 0.67402 (16) | 0.06715 (16) | 0.0235 (4) | |
| N5 | 0.43829 (17) | 0.50979 (16) | −0.12465 (15) | 0.0229 (4) | |
| N6 | 0.2192 (2) | 0.1156 (2) | 0.3096 (2) | 0.0385 (5) | |
| C1 | −0.0878 (2) | 0.47431 (18) | 0.09971 (18) | 0.0217 (4) | |
| C2 | −0.0740 (2) | 0.58216 (18) | 0.09225 (18) | 0.0236 (4) | |
| H2A | −0.1231 | 0.6381 | 0.1539 | 0.028* | |
| C3 | 0.0115 (2) | 0.60781 (18) | −0.00522 (19) | 0.0239 (4) | |
| H3A | 0.0181 | 0.6807 | −0.0077 | 0.029* | |
| C4 | −0.1965 (2) | 0.34561 (19) | 0.21331 (19) | 0.0252 (4) | |
| H4A | −0.1872 | 0.3157 | 0.1407 | 0.030* | |
| H4B | −0.2841 | 0.3614 | 0.2657 | 0.030* | |
| C5 | −0.1659 (2) | 0.24715 (19) | 0.42484 (18) | 0.0233 (4) | |
| C6 | −0.2826 (3) | 0.3388 (2) | 0.4826 (2) | 0.0369 (5) | |
| H6A | −0.3246 | 0.3960 | 0.4420 | 0.044* | |
| C7 | −0.3369 (3) | 0.3449 (3) | 0.6016 (2) | 0.0450 (7) | |
| H7A | −0.4155 | 0.4060 | 0.6399 | 0.054* | |
| C8 | −0.2757 (3) | 0.2619 (3) | 0.6627 (2) | 0.0456 (7) | |
| H8A | −0.3124 | 0.2669 | 0.7421 | 0.055* | |
| C9 | −0.1597 (3) | 0.1711 (3) | 0.6061 (2) | 0.0435 (6) | |
| H9A | −0.1184 | 0.1141 | 0.6473 | 0.052* | |
| C10 | −0.1044 (3) | 0.1641 (2) | 0.4884 (2) | 0.0346 (5) | |
| H10A | −0.0252 | 0.1032 | 0.4511 | 0.042* | |
| C11 | −0.1028 (2) | 0.09916 (18) | 0.23379 (18) | 0.0225 (4) | |
| C12 | 0.0021 (2) | 0.0079 (2) | 0.1606 (2) | 0.0340 (5) | |
| H12A | 0.0829 | 0.0121 | 0.1315 | 0.041* | |
| C13 | −0.0124 (3) | −0.0894 (2) | 0.1304 (3) | 0.0458 (7) | |
| H13A | 0.0584 | −0.1500 | 0.0808 | 0.055* | |
| C14 | −0.1316 (3) | −0.0966 (2) | 0.1738 (3) | 0.0422 (6) | |
| H14A | −0.1408 | −0.1629 | 0.1547 | 0.051* | |
| C15 | −0.2375 (3) | −0.0056 (2) | 0.2456 (2) | 0.0394 (6) | |
| H15A | −0.3182 | −0.0101 | 0.2737 | 0.047* | |
| C16 | −0.2240 (2) | 0.0923 (2) | 0.2760 (2) | 0.0314 (5) | |
| H16A | −0.2955 | 0.1535 | 0.3244 | 0.038* | |
| C17 | 0.3083 (2) | 0.16616 (19) | −0.0179 (2) | 0.0285 (5) | |
| H17A | 0.2994 | 0.0942 | −0.0134 | 0.034* | |
| C18 | 0.3884 (2) | 0.1896 (2) | −0.1201 (2) | 0.0323 (5) | |
| H18A | 0.4305 | 0.1351 | −0.1829 | 0.039* | |
| C19 | 0.4051 (2) | 0.2946 (2) | −0.12743 (19) | 0.0266 (4) | |
| H19A | 0.4584 | 0.3120 | −0.1954 | 0.032* | |
| C20 | 0.3411 (2) | 0.37443 (18) | −0.03170 (18) | 0.0221 (4) | |
| C21 | 0.25879 (19) | 0.34513 (18) | 0.06730 (17) | 0.0203 (4) | |
| C22 | 0.35395 (19) | 0.48708 (18) | −0.03267 (17) | 0.0203 (4) | |
| C23 | 0.4471 (2) | 0.61545 (19) | −0.12338 (18) | 0.0228 (4) | |
| C24 | 0.5343 (2) | 0.6453 (2) | −0.2205 (2) | 0.0284 (5) | |
| H24A | 0.5846 | 0.5925 | −0.2846 | 0.034* | |
| C25 | 0.5442 (2) | 0.7513 (2) | −0.2196 (2) | 0.0319 (5) | |
| H25A | 0.6007 | 0.7708 | −0.2836 | 0.038* | |
| C26 | 0.4696 (2) | 0.8321 (2) | −0.1225 (2) | 0.0321 (5) | |
| H26A | 0.4793 | 0.9033 | −0.1228 | 0.039* | |
| C27 | 0.3836 (2) | 0.8074 (2) | −0.0283 (2) | 0.0293 (5) | |
| H27A | 0.3344 | 0.8619 | 0.0346 | 0.035* | |
| C28 | 0.3696 (2) | 0.69847 (19) | −0.02664 (19) | 0.0233 (4) | |
| C29 | 0.27640 (19) | 0.57019 (18) | 0.06501 (17) | 0.0208 (4) | |
| C30 | 0.1861 (2) | 0.54033 (19) | 0.16478 (17) | 0.0213 (4) | |
| C31 | 0.1007 (2) | 0.6216 (2) | 0.25919 (19) | 0.0272 (4) | |
| H31A | 0.1013 | 0.6966 | 0.2607 | 0.033* | |
| C32 | 0.0160 (2) | 0.5884 (2) | 0.3496 (2) | 0.0321 (5) | |
| H32A | −0.0428 | 0.6413 | 0.4122 | 0.039* | |
| C33 | 0.0201 (2) | 0.4748 (2) | 0.34555 (19) | 0.0304 (5) | |
| H33A | −0.0359 | 0.4526 | 0.4077 | 0.037* | |
| C34 | 0.18047 (19) | 0.42966 (19) | 0.16690 (17) | 0.0214 (4) | |
| C35 | 0.2723 (3) | 0.0633 (3) | 0.3657 (3) | 0.0412 (6) | |
| C36 | 0.3417 (4) | −0.0034 (4) | 0.4389 (3) | 0.0687 (11) | |
| H36A | 0.4198 | 0.0095 | 0.4199 | 0.103* | |
| H36B | 0.3627 | −0.0862 | 0.4274 | 0.103* | |
| H36C | 0.2882 | 0.0225 | 0.5174 | 0.103* | |
| B1 | 0.3624 (3) | 0.2824 (3) | 0.5497 (3) | 0.0415 (7) | |
| F1 | 0.3397 (4) | 0.3829 (3) | 0.5988 (3) | 0.1497 (16) | |
| F2 | 0.2814 (2) | 0.2991 (4) | 0.4946 (2) | 0.1521 (18) | |
| F3 | 0.3415 (4) | 0.2126 (3) | 0.6392 (3) | 0.1330 (13) | |
| F4 | 0.4840 (2) | 0.2329 (3) | 0.47575 (19) | 0.0965 (9) |
| Cu1 | 0.02530 (15) | 0.03051 (16) | 0.02609 (16) | −0.01641 (12) | −0.00980 (11) | 0.01035 (11) |
| P2 | 0.0219 (3) | 0.0217 (3) | 0.0183 (3) | −0.0115 (2) | −0.0070 (2) | 0.00549 (19) |
| N1 | 0.0339 (10) | 0.0211 (8) | 0.0254 (10) | −0.0120 (8) | −0.0094 (8) | 0.0054 (7) |
| N2 | 0.0240 (9) | 0.0328 (10) | 0.0186 (9) | −0.0149 (8) | −0.0074 (7) | 0.0058 (7) |
| N3 | 0.0220 (8) | 0.0247 (9) | 0.0244 (9) | −0.0103 (7) | −0.0085 (7) | 0.0052 (7) |
| N4 | 0.0230 (9) | 0.0243 (9) | 0.0239 (9) | −0.0097 (7) | −0.0090 (7) | 0.0021 (7) |
| N5 | 0.0222 (8) | 0.0267 (9) | 0.0211 (9) | −0.0115 (7) | −0.0080 (7) | 0.0044 (7) |
| N6 | 0.0364 (11) | 0.0447 (12) | 0.0473 (13) | −0.0256 (10) | −0.0234 (10) | 0.0239 (10) |
| C1 | 0.0260 (10) | 0.0210 (9) | 0.0223 (10) | −0.0100 (8) | −0.0137 (8) | 0.0071 (8) |
| C2 | 0.0301 (11) | 0.0208 (10) | 0.0224 (10) | −0.0094 (9) | −0.0133 (9) | 0.0030 (8) |
| C3 | 0.0318 (11) | 0.0188 (9) | 0.0266 (11) | −0.0118 (9) | −0.0154 (9) | 0.0055 (8) |
| C4 | 0.0257 (10) | 0.0267 (10) | 0.0262 (11) | −0.0122 (9) | −0.0122 (9) | 0.0092 (8) |
| C5 | 0.0277 (10) | 0.0276 (10) | 0.0190 (10) | −0.0173 (9) | −0.0067 (8) | 0.0024 (8) |
| C6 | 0.0361 (13) | 0.0379 (13) | 0.0299 (13) | −0.0126 (11) | −0.0062 (10) | −0.0005 (10) |
| C7 | 0.0399 (14) | 0.0537 (17) | 0.0315 (14) | −0.0204 (13) | 0.0034 (11) | −0.0143 (12) |
| C8 | 0.0491 (16) | 0.079 (2) | 0.0187 (12) | −0.0401 (16) | −0.0059 (11) | −0.0017 (12) |
| C9 | 0.0506 (16) | 0.0622 (18) | 0.0270 (13) | −0.0295 (15) | −0.0184 (12) | 0.0127 (12) |
| C10 | 0.0368 (13) | 0.0413 (13) | 0.0247 (12) | −0.0149 (11) | −0.0114 (10) | 0.0063 (10) |
| C11 | 0.0289 (10) | 0.0214 (9) | 0.0192 (10) | −0.0110 (9) | −0.0102 (8) | 0.0037 (8) |
| C12 | 0.0303 (12) | 0.0300 (12) | 0.0368 (13) | −0.0082 (10) | −0.0103 (10) | −0.0012 (10) |
| C13 | 0.0467 (16) | 0.0277 (12) | 0.0545 (18) | −0.0031 (12) | −0.0192 (14) | −0.0102 (12) |
| C14 | 0.0585 (17) | 0.0266 (12) | 0.0513 (17) | −0.0180 (12) | −0.0291 (14) | 0.0012 (11) |
| C15 | 0.0446 (15) | 0.0397 (14) | 0.0466 (16) | −0.0259 (12) | −0.0208 (12) | 0.0062 (12) |
| C16 | 0.0318 (12) | 0.0314 (12) | 0.0311 (12) | −0.0154 (10) | −0.0076 (10) | −0.0011 (9) |
| C17 | 0.0316 (11) | 0.0220 (10) | 0.0310 (12) | −0.0119 (9) | −0.0087 (10) | 0.0003 (9) |
| C18 | 0.0355 (12) | 0.0278 (11) | 0.0280 (12) | −0.0121 (10) | −0.0047 (10) | −0.0041 (9) |
| C19 | 0.0264 (11) | 0.0287 (11) | 0.0206 (10) | −0.0119 (9) | −0.0026 (8) | 0.0002 (8) |
| C20 | 0.0210 (9) | 0.0235 (10) | 0.0215 (10) | −0.0083 (8) | −0.0084 (8) | 0.0032 (8) |
| C21 | 0.0205 (9) | 0.0220 (9) | 0.0205 (10) | −0.0097 (8) | −0.0089 (8) | 0.0039 (8) |
| C22 | 0.0193 (9) | 0.0231 (10) | 0.0194 (10) | −0.0091 (8) | −0.0076 (8) | 0.0035 (8) |
| C23 | 0.0208 (9) | 0.0272 (10) | 0.0229 (10) | −0.0115 (8) | −0.0095 (8) | 0.0059 (8) |
| C24 | 0.0257 (11) | 0.0339 (12) | 0.0255 (11) | −0.0146 (10) | −0.0070 (9) | 0.0060 (9) |
| C25 | 0.0296 (11) | 0.0371 (12) | 0.0339 (13) | −0.0198 (10) | −0.0120 (10) | 0.0128 (10) |
| C26 | 0.0317 (12) | 0.0269 (11) | 0.0421 (14) | −0.0159 (10) | −0.0151 (11) | 0.0095 (10) |
| C27 | 0.0288 (11) | 0.0241 (11) | 0.0352 (13) | −0.0105 (9) | −0.0122 (10) | 0.0029 (9) |
| C28 | 0.0213 (10) | 0.0242 (10) | 0.0268 (11) | −0.0097 (8) | −0.0113 (8) | 0.0058 (8) |
| C29 | 0.0200 (9) | 0.0235 (10) | 0.0198 (10) | −0.0084 (8) | −0.0085 (8) | 0.0026 (8) |
| C30 | 0.0210 (9) | 0.0258 (10) | 0.0185 (10) | −0.0104 (8) | −0.0079 (8) | 0.0029 (8) |
| C31 | 0.0275 (11) | 0.0306 (11) | 0.0230 (11) | −0.0125 (9) | −0.0068 (9) | −0.0012 (9) |
| C32 | 0.0319 (12) | 0.0409 (13) | 0.0201 (11) | −0.0161 (11) | −0.0028 (9) | −0.0030 (9) |
| C33 | 0.0289 (11) | 0.0440 (13) | 0.0176 (10) | −0.0184 (11) | −0.0035 (9) | 0.0031 (9) |
| C34 | 0.0189 (9) | 0.0291 (10) | 0.0180 (10) | −0.0101 (8) | −0.0085 (8) | 0.0049 (8) |
| C35 | 0.0403 (14) | 0.0471 (15) | 0.0474 (16) | −0.0264 (13) | −0.0222 (13) | 0.0224 (13) |
| C36 | 0.075 (2) | 0.082 (3) | 0.069 (2) | −0.035 (2) | −0.051 (2) | 0.041 (2) |
| B1 | 0.0398 (16) | 0.0427 (16) | 0.0314 (15) | −0.0105 (14) | −0.0062 (13) | −0.0043 (12) |
| F1 | 0.203 (4) | 0.0699 (18) | 0.118 (3) | −0.039 (2) | −0.001 (3) | −0.0445 (17) |
| F2 | 0.0429 (13) | 0.326 (5) | 0.0545 (15) | −0.038 (2) | −0.0104 (11) | −0.029 (2) |
| F3 | 0.194 (4) | 0.138 (3) | 0.089 (2) | −0.106 (3) | −0.043 (2) | 0.058 (2) |
| F4 | 0.0443 (11) | 0.151 (2) | 0.0487 (13) | 0.0050 (13) | −0.0107 (10) | −0.0139 (14) |
| Cu1—N2 | 2.0828 (19) | C13—H13A | 0.9300 |
| Cu1—N3 | 2.0628 (18) | C14—C15 | 1.382 (4) |
| Cu1—N6 | 2.013 (2) | C14—H14A | 0.9300 |
| Cu1—P2 | 2.1883 (6) | C15—C16 | 1.385 (3) |
| P2—C11 | 1.820 (2) | C15—H15A | 0.9300 |
| P2—C5 | 1.826 (2) | C16—H16A | 0.9300 |
| P2—C4 | 1.862 (2) | C17—C18 | 1.384 (3) |
| N1—C1 | 1.389 (3) | C17—H17A | 0.9300 |
| N1—C4 | 1.435 (3) | C18—C19 | 1.378 (3) |
| N1—H1A | 0.8600 | C18—H18A | 0.9300 |
| N2—C33 | 1.331 (3) | C19—C20 | 1.395 (3) |
| N2—C34 | 1.357 (3) | C19—H19A | 0.9300 |
| N3—C17 | 1.333 (3) | C20—C21 | 1.402 (3) |
| N3—C21 | 1.353 (3) | C20—C22 | 1.457 (3) |
| N4—C29 | 1.326 (3) | C21—C34 | 1.461 (3) |
| N4—C28 | 1.354 (3) | C22—C29 | 1.435 (3) |
| N5—C22 | 1.326 (3) | C23—C24 | 1.422 (3) |
| N5—C23 | 1.351 (3) | C23—C28 | 1.426 (3) |
| N6—C35 | 1.123 (3) | C24—C25 | 1.361 (3) |
| C1—C2 | 1.396 (3) | C24—H24A | 0.9300 |
| C1—C3i | 1.400 (3) | C25—C26 | 1.413 (4) |
| C2—C3 | 1.390 (3) | C25—H25A | 0.9300 |
| C2—H2A | 0.9300 | C26—C27 | 1.363 (3) |
| C3—C1i | 1.400 (3) | C26—H26A | 0.9300 |
| C3—H3A | 0.9300 | C27—C28 | 1.417 (3) |
| C4—H4A | 0.9700 | C27—H27A | 0.9300 |
| C4—H4B | 0.9700 | C29—C30 | 1.461 (3) |
| C5—C6 | 1.389 (3) | C30—C34 | 1.391 (3) |
| C5—C10 | 1.394 (3) | C30—C31 | 1.405 (3) |
| C6—C7 | 1.394 (4) | C31—C32 | 1.380 (3) |
| C6—H6A | 0.9300 | C31—H31A | 0.9300 |
| C7—C8 | 1.370 (5) | C32—C33 | 1.388 (3) |
| C7—H7A | 0.9300 | C32—H32A | 0.9300 |
| C8—C9 | 1.377 (4) | C33—H33A | 0.9300 |
| C8—H8A | 0.9300 | C35—C36 | 1.460 (4) |
| C9—C10 | 1.380 (4) | C36—H36A | 0.9600 |
| C9—H9A | 0.9300 | C36—H36B | 0.9600 |
| C10—H10A | 0.9300 | C36—H36C | 0.9600 |
| C11—C12 | 1.386 (3) | B1—F1 | 1.317 (4) |
| C11—C16 | 1.398 (3) | B1—F4 | 1.336 (4) |
| C12—C13 | 1.384 (4) | B1—F2 | 1.345 (4) |
| C12—H12A | 0.9300 | B1—F3 | 1.368 (4) |
| C13—C14 | 1.378 (4) | ||
| N6—Cu1—N3 | 103.38 (8) | C16—C15—H15A | 119.9 |
| N6—Cu1—N2 | 106.93 (8) | C15—C16—C11 | 119.9 (2) |
| N3—Cu1—N2 | 80.51 (7) | C15—C16—H16A | 120.1 |
| N6—Cu1—P2 | 116.55 (6) | C11—C16—H16A | 120.1 |
| N3—Cu1—P2 | 130.67 (5) | N3—C17—C18 | 123.2 (2) |
| N2—Cu1—P2 | 111.75 (5) | N3—C17—H17A | 118.4 |
| C11—P2—C5 | 102.19 (9) | C18—C17—H17A | 118.4 |
| C11—P2—C4 | 99.92 (10) | C19—C18—C17 | 119.2 (2) |
| C5—P2—C4 | 104.86 (10) | C19—C18—H18A | 120.4 |
| C11—P2—Cu1 | 121.19 (7) | C17—C18—H18A | 120.4 |
| C5—P2—Cu1 | 108.62 (7) | C18—C19—C20 | 119.2 (2) |
| C4—P2—Cu1 | 117.95 (7) | C18—C19—H19A | 120.4 |
| C1—N1—C4 | 122.88 (19) | C20—C19—H19A | 120.4 |
| C1—N1—H1A | 118.6 | C19—C20—C21 | 117.91 (19) |
| C4—N1—H1A | 118.6 | C19—C20—C22 | 122.42 (19) |
| C33—N2—C34 | 117.71 (19) | C21—C20—C22 | 119.64 (18) |
| C33—N2—Cu1 | 129.25 (15) | N3—C21—C20 | 122.67 (19) |
| C34—N2—Cu1 | 112.74 (14) | N3—C21—C34 | 116.87 (18) |
| C17—N3—C21 | 117.82 (18) | C20—C21—C34 | 120.39 (18) |
| C17—N3—Cu1 | 128.72 (15) | N5—C22—C29 | 121.64 (18) |
| C21—N3—Cu1 | 113.35 (14) | N5—C22—C20 | 118.60 (18) |
| C29—N4—C28 | 117.24 (18) | C29—C22—C20 | 119.75 (18) |
| C22—N5—C23 | 117.20 (18) | N5—C23—C24 | 119.6 (2) |
| C35—N6—Cu1 | 171.4 (3) | N5—C23—C28 | 121.26 (19) |
| N1—C1—C2 | 119.23 (19) | C24—C23—C28 | 119.15 (19) |
| N1—C1—C3i | 123.28 (19) | C25—C24—C23 | 119.9 (2) |
| C2—C1—C3i | 117.44 (19) | C25—C24—H24A | 120.0 |
| C3—C2—C1 | 121.5 (2) | C23—C24—H24A | 120.0 |
| C3—C2—H2A | 119.2 | C24—C25—C26 | 120.8 (2) |
| C1—C2—H2A | 119.2 | C24—C25—H25A | 119.6 |
| C2—C3—C1i | 121.04 (19) | C26—C25—H25A | 119.6 |
| C2—C3—H3A | 119.5 | C27—C26—C25 | 121.1 (2) |
| C1i—C3—H3A | 119.5 | C27—C26—H26A | 119.5 |
| N1—C4—P2 | 115.05 (15) | C25—C26—H26A | 119.5 |
| N1—C4—H4A | 108.5 | C26—C27—C28 | 119.7 (2) |
| P2—C4—H4A | 108.5 | C26—C27—H27A | 120.1 |
| N1—C4—H4B | 108.5 | C28—C27—H27A | 120.1 |
| P2—C4—H4B | 108.5 | N4—C28—C27 | 119.6 (2) |
| H4A—C4—H4B | 107.5 | N4—C28—C23 | 121.04 (19) |
| C6—C5—C10 | 118.6 (2) | C27—C28—C23 | 119.3 (2) |
| C6—C5—P2 | 124.84 (18) | N4—C29—C22 | 121.61 (19) |
| C10—C5—P2 | 116.59 (18) | N4—C29—C30 | 118.87 (18) |
| C5—C6—C7 | 119.9 (3) | C22—C29—C30 | 119.51 (18) |
| C5—C6—H6A | 120.0 | C34—C30—C31 | 118.03 (19) |
| C7—C6—H6A | 120.0 | C34—C30—C29 | 119.96 (18) |
| C8—C7—C6 | 120.8 (3) | C31—C30—C29 | 121.99 (19) |
| C8—C7—H7A | 119.6 | C32—C31—C30 | 119.0 (2) |
| C6—C7—H7A | 119.6 | C32—C31—H31A | 120.5 |
| C7—C8—C9 | 119.7 (2) | C30—C31—H31A | 120.5 |
| C7—C8—H8A | 120.2 | C31—C32—C33 | 118.9 (2) |
| C9—C8—H8A | 120.2 | C31—C32—H32A | 120.6 |
| C8—C9—C10 | 120.3 (3) | C33—C32—H32A | 120.6 |
| C8—C9—H9A | 119.9 | N2—C33—C32 | 123.5 (2) |
| C10—C9—H9A | 119.9 | N2—C33—H33A | 118.3 |
| C9—C10—C5 | 120.8 (3) | C32—C33—H33A | 118.3 |
| C9—C10—H10A | 119.6 | N2—C34—C30 | 122.87 (19) |
| C5—C10—H10A | 119.6 | N2—C34—C21 | 116.53 (18) |
| C12—C11—C16 | 119.2 (2) | C30—C34—C21 | 120.54 (18) |
| C12—C11—P2 | 119.89 (17) | N6—C35—C36 | 179.3 (3) |
| C16—C11—P2 | 120.85 (17) | C35—C36—H36A | 109.5 |
| C13—C12—C11 | 120.5 (2) | C35—C36—H36B | 109.5 |
| C13—C12—H12A | 119.8 | H36A—C36—H36B | 109.5 |
| C11—C12—H12A | 119.8 | C35—C36—H36C | 109.5 |
| C14—C13—C12 | 120.1 (3) | H36A—C36—H36C | 109.5 |
| C14—C13—H13A | 119.9 | H36B—C36—H36C | 109.5 |
| C12—C13—H13A | 119.9 | F1—B1—F4 | 111.9 (3) |
| C13—C14—C15 | 120.1 (2) | F1—B1—F2 | 110.7 (4) |
| C13—C14—H14A | 120.0 | F4—B1—F2 | 108.9 (3) |
| C15—C14—H14A | 120.0 | F1—B1—F3 | 103.6 (3) |
| C14—C15—C16 | 120.2 (2) | F4—B1—F3 | 110.1 (3) |
| C14—C15—H15A | 119.9 | F2—B1—F3 | 111.5 (3) |
Selected bond lengths (Å)
| Cu1—N2 | 2.0828 (19) |
| Cu1—N3 | 2.0628 (18) |
| Cu1—N6 | 2.013 (2) |
| Cu1—P2 | 2.1883 (6) |