| Literature DB >> 21200513 |
Lara C Spencer, Haris Bjelosevic, James Darkwa, Sofi K C Elmroth, Tina Persson.
Abstract
The dinuclear title compound, [FePtCl(2)(C(17)H(14)P)(C(23)H(23)NO(3)P)]·1.25CH(2)Cl(2), has a slightly distorted cis-PtCl(2)P(2) square-planar geometry around the Pt atom, and the ferrocenylphosphine ligands are staggered at an angle of 29.4 (2)° about Pt. In the crystal structure, the complex forms centrosymmetric dimers via two strong inter-molecular O-H⋯O bonds resulting in R(2) (2)(8) rings. A weak intra-molecular N-H⋯Cl bond leads to an S(8) motif. The solvent is highly disordered and has not been modelled with discrete atoms.Entities:
Year: 2007 PMID: 21200513 PMCID: PMC2915101 DOI: 10.1107/S1600536807065105
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [FePtCl2(C17H14P)(C23H23NO3P)]·1.25CH2Cl2 | |
| Monoclinic, | Mo- |
| Hall symbol: -P 2yn | Cell parameters from 21973 reflections |
| θ = 2.2–29.6º | |
| µ = 4.39 mm−1 | |
| β = 100.916 (1)º | Block, yellow |
| 0.35 × 0.33 × 0.30 mm | |
| Bruker SMART1000 CCD diffractometer | 10833 independent reflections |
| Radiation source: fine-focus sealed tube | 9395 reflections with |
| Monochromator: graphite | |
| θmax = 29.6º | |
| ω scans | θmin = 1.7º |
| Absorption correction: multi-scan(SADABS; Bruker, 2003) | |
| 56419 measured reflections |
| Refinement on | Secondary atom site location: difference Fourier map |
| Least-squares matrix: full | Hydrogen site location: inferred from neighbouring sites |
| H-atom parameters constrained | |
| | |
| (Δ/σ)max = 0.001 | |
| 10833 reflections | Δρmax = 1.45 e Å−3 |
| 453 parameters | Δρmin = −0.48 e Å−3 |
| Primary atom site location: structure-invariant direct methods | Extinction correction: none |
| 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 takeninto account individually in the estimation of e.s.d.'s in distances, anglesand torsion angles; correlations between e.s.d.'s in cell parameters are onlyused 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 |
| Pt1 | 0.517748 (7) | 0.236711 (6) | 0.227608 (5) | 0.01205 (3) | |
| Fe1 | 0.40957 (3) | 0.25793 (2) | 0.007455 (19) | 0.01408 (7) | |
| Cl1 | 0.67981 (5) | 0.17995 (4) | 0.28377 (3) | 0.02068 (13) | |
| Cl2 | 0.52630 (5) | 0.32416 (4) | 0.32745 (3) | 0.01833 (12) | |
| P1 | 0.50312 (5) | 0.13556 (4) | 0.14368 (3) | 0.01277 (12) | |
| P2 | 0.38650 (5) | 0.32092 (4) | 0.17376 (3) | 0.01277 (12) | |
| O1 | 0.79978 (17) | 0.22592 (16) | 0.02709 (11) | 0.0341 (5) | |
| O2 | 1.05274 (17) | 0.10838 (14) | 0.00910 (12) | 0.0318 (5) | |
| H2 | 1.0534 | 0.0631 | −0.0136 | 0.048* | |
| O3 | 0.93828 (15) | 0.03658 (14) | 0.05916 (11) | 0.0305 (5) | |
| N1 | 0.73423 (17) | 0.25400 (14) | 0.12523 (13) | 0.0182 (4) | |
| H1 | 0.7435 | 0.2469 | 0.1711 | 0.022* | |
| C1 | 0.45365 (19) | 0.13779 (16) | −0.00883 (13) | 0.0174 (5) | |
| H1A | 0.4073 | 0.0868 | −0.0140 | 0.021* | |
| C2 | 0.4742 (2) | 0.18988 (18) | −0.06440 (13) | 0.0202 (5) | |
| H2A | 0.4430 | 0.1828 | −0.1155 | 0.024* | |
| C3 | 0.5439 (2) | 0.25468 (17) | −0.03527 (14) | 0.0187 (5) | |
| H3 | 0.5692 | 0.3017 | −0.0624 | 0.022* | |
| C4 | 0.56845 (19) | 0.24502 (15) | 0.03934 (14) | 0.0157 (5) | |
| C5 | 0.51106 (18) | 0.17171 (16) | 0.05675 (13) | 0.0142 (5) | |
| C6 | 0.64074 (19) | 0.30043 (17) | 0.09061 (13) | 0.0171 (5) | |
| H6 | 0.6016 | 0.3165 | 0.1284 | 0.021* | |
| C7 | 0.6698 (2) | 0.38307 (18) | 0.05800 (15) | 0.0241 (6) | |
| H7A | 0.7097 | 0.4191 | 0.0949 | 0.036* | |
| H7B | 0.6059 | 0.4126 | 0.0356 | 0.036* | |
| H7C | 0.7125 | 0.3705 | 0.0226 | 0.036* | |
| C8 | 0.8071 (2) | 0.22138 (18) | 0.09118 (16) | 0.0239 (6) | |
| C9 | 0.8993 (2) | 0.1799 (2) | 0.13841 (16) | 0.0270 (6) | |
| H9A | 0.8792 | 0.1222 | 0.1509 | 0.032* | |
| H9B | 0.9180 | 0.2129 | 0.1825 | 0.032* | |
| C10 | 0.9939 (2) | 0.1743 (2) | 0.10304 (17) | 0.0284 (6) | |
| H10A | 0.9983 | 0.2268 | 0.0757 | 0.034* | |
| H10B | 1.0580 | 0.1707 | 0.1398 | 0.034* | |
| C11 | 0.9903 (2) | 0.09984 (19) | 0.05495 (16) | 0.0251 (6) | |
| C12 | 0.59865 (18) | 0.05016 (16) | 0.16185 (13) | 0.0157 (5) | |
| C13 | 0.67153 (19) | 0.03441 (16) | 0.11885 (14) | 0.0178 (5) | |
| H13 | 0.6758 | 0.0711 | 0.0806 | 0.021* | |
| C14 | 0.7377 (2) | −0.03525 (17) | 0.13238 (15) | 0.0219 (6) | |
| H14 | 0.7876 | −0.0459 | 0.1033 | 0.026* | |
| C15 | 0.7315 (2) | −0.08917 (17) | 0.18795 (16) | 0.0242 (6) | |
| H15 | 0.7755 | −0.1376 | 0.1960 | 0.029* | |
| C16 | 0.66108 (19) | −0.07251 (17) | 0.23194 (15) | 0.0200 (5) | |
| H16 | 0.6585 | −0.1085 | 0.2709 | 0.024* | |
| C17 | 0.59439 (19) | −0.00311 (16) | 0.21893 (14) | 0.0189 (5) | |
| H17 | 0.5459 | 0.0081 | 0.2489 | 0.023* | |
| C18 | 0.38247 (18) | 0.07400 (16) | 0.13510 (13) | 0.0141 (5) | |
| C19 | 0.36812 (19) | 0.00308 (16) | 0.09043 (13) | 0.0166 (5) | |
| H19 | 0.4207 | −0.0121 | 0.0647 | 0.020* | |
| C20 | 0.2775 (2) | −0.04485 (17) | 0.08379 (14) | 0.0219 (5) | |
| H20 | 0.2667 | −0.0911 | 0.0518 | 0.026* | |
| C21 | 0.2025 (2) | −0.02546 (18) | 0.12373 (15) | 0.0237 (6) | |
| H21 | 0.1403 | −0.0582 | 0.1191 | 0.028* | |
| C22 | 0.2191 (2) | 0.04204 (18) | 0.17043 (14) | 0.0217 (5) | |
| H22 | 0.1689 | 0.0541 | 0.1990 | 0.026* | |
| C23 | 0.30772 (19) | 0.09213 (17) | 0.17606 (13) | 0.0178 (5) | |
| H23 | 0.3176 | 0.1387 | 0.2077 | 0.021* | |
| C24 | 0.26636 (19) | 0.31782 (16) | 0.20920 (14) | 0.0168 (5) | |
| C25 | 0.2685 (2) | 0.28888 (17) | 0.27762 (14) | 0.0197 (5) | |
| H25 | 0.3311 | 0.2659 | 0.3043 | 0.024* | |
| C26 | 0.1784 (2) | 0.29372 (18) | 0.30681 (16) | 0.0259 (6) | |
| H26 | 0.1801 | 0.2749 | 0.3537 | 0.031* | |
| C27 | 0.0872 (2) | 0.32574 (18) | 0.26774 (17) | 0.0283 (7) | |
| H27 | 0.0262 | 0.3290 | 0.2879 | 0.034* | |
| C28 | 0.0838 (2) | 0.35315 (19) | 0.19946 (17) | 0.0277 (6) | |
| H28 | 0.0205 | 0.3752 | 0.1729 | 0.033* | |
| C29 | 0.17282 (19) | 0.34854 (17) | 0.16937 (15) | 0.0215 (5) | |
| H29 | 0.1700 | 0.3662 | 0.1221 | 0.026* | |
| C30 | 0.4300 (2) | 0.43184 (16) | 0.18119 (13) | 0.0161 (5) | |
| C31 | 0.3561 (2) | 0.49628 (17) | 0.16439 (14) | 0.0204 (5) | |
| H31 | 0.2839 | 0.4825 | 0.1521 | 0.024* | |
| C32 | 0.3874 (2) | 0.57983 (18) | 0.16548 (15) | 0.0272 (6) | |
| H32 | 0.3366 | 0.6233 | 0.1541 | 0.033* | |
| C33 | 0.4933 (2) | 0.60076 (18) | 0.18318 (14) | 0.0255 (6) | |
| H33 | 0.5146 | 0.6584 | 0.1843 | 0.031* | |
| C34 | 0.5667 (2) | 0.53766 (18) | 0.19900 (14) | 0.0239 (6) | |
| H34 | 0.6389 | 0.5516 | 0.2103 | 0.029* | |
| C35 | 0.5351 (2) | 0.45313 (17) | 0.19849 (13) | 0.0176 (5) | |
| H35 | 0.5861 | 0.4098 | 0.2101 | 0.021* | |
| C36 | 0.33884 (18) | 0.31513 (16) | 0.07995 (13) | 0.0152 (5) | |
| C37 | 0.35963 (19) | 0.37625 (16) | 0.02881 (13) | 0.0176 (5) | |
| H37 | 0.4048 | 0.4277 | 0.0392 | 0.021* | |
| C38 | 0.3063 (2) | 0.35052 (18) | −0.03852 (14) | 0.0219 (5) | |
| H38 | 0.3082 | 0.3801 | −0.0840 | 0.026* | |
| C39 | 0.2515 (2) | 0.27440 (18) | −0.03070 (14) | 0.0202 (5) | |
| H39 | 0.2084 | 0.2413 | −0.0698 | 0.024* | |
| C40 | 0.2707 (2) | 0.25155 (16) | 0.04190 (15) | 0.0168 (5) | |
| H40 | 0.2421 | 0.2008 | 0.0627 | 0.020* |
| Pt1 | 0.01341 (5) | 0.01136 (5) | 0.01105 (5) | 0.00026 (3) | 0.00150 (3) | −0.00018 (3) |
| Fe1 | 0.01480 (16) | 0.01564 (18) | 0.01161 (17) | 0.00201 (13) | 0.00204 (13) | −0.00002 (13) |
| Cl1 | 0.0199 (3) | 0.0201 (3) | 0.0190 (3) | 0.0042 (2) | −0.0041 (2) | −0.0016 (2) |
| Cl2 | 0.0228 (3) | 0.0180 (3) | 0.0140 (3) | −0.0016 (2) | 0.0032 (2) | −0.0037 (2) |
| P1 | 0.0125 (3) | 0.0119 (3) | 0.0137 (3) | 0.0011 (2) | 0.0020 (2) | −0.0003 (2) |
| P2 | 0.0134 (3) | 0.0122 (3) | 0.0130 (3) | 0.0009 (2) | 0.0033 (2) | −0.0007 (2) |
| O1 | 0.0255 (11) | 0.0534 (15) | 0.0224 (11) | 0.0109 (10) | 0.0022 (9) | −0.0106 (10) |
| O2 | 0.0305 (11) | 0.0261 (12) | 0.0414 (13) | −0.0034 (9) | 0.0135 (10) | −0.0064 (10) |
| O3 | 0.0255 (10) | 0.0285 (12) | 0.0391 (13) | −0.0023 (9) | 0.0104 (9) | −0.0088 (10) |
| N1 | 0.0158 (10) | 0.0208 (12) | 0.0176 (11) | 0.0015 (8) | 0.0020 (9) | −0.0007 (8) |
| C1 | 0.0191 (11) | 0.0160 (12) | 0.0173 (12) | 0.0012 (9) | 0.0040 (10) | −0.0051 (10) |
| C2 | 0.0223 (12) | 0.0258 (15) | 0.0133 (12) | 0.0031 (10) | 0.0058 (10) | −0.0029 (10) |
| C3 | 0.0213 (12) | 0.0211 (14) | 0.0151 (12) | 0.0024 (10) | 0.0068 (10) | 0.0024 (10) |
| C4 | 0.0135 (11) | 0.0160 (12) | 0.0182 (12) | 0.0021 (9) | 0.0048 (9) | −0.0006 (9) |
| C5 | 0.0131 (10) | 0.0147 (12) | 0.0152 (11) | 0.0017 (9) | 0.0041 (9) | 0.0003 (9) |
| C6 | 0.0147 (11) | 0.0177 (13) | 0.0191 (12) | 0.0001 (9) | 0.0035 (9) | 0.0009 (10) |
| C7 | 0.0240 (13) | 0.0186 (14) | 0.0293 (15) | −0.0036 (10) | 0.0040 (11) | 0.0040 (11) |
| C8 | 0.0175 (12) | 0.0259 (15) | 0.0270 (15) | 0.0025 (10) | 0.0009 (11) | −0.0081 (12) |
| C9 | 0.0190 (13) | 0.0311 (16) | 0.0294 (15) | 0.0060 (11) | 0.0012 (11) | −0.0057 (12) |
| C10 | 0.0180 (12) | 0.0279 (16) | 0.0369 (17) | 0.0028 (11) | −0.0007 (12) | −0.0074 (13) |
| C11 | 0.0180 (12) | 0.0235 (15) | 0.0319 (16) | 0.0034 (10) | 0.0001 (11) | −0.0033 (12) |
| C12 | 0.0138 (11) | 0.0121 (12) | 0.0205 (13) | 0.0009 (9) | 0.0009 (9) | −0.0028 (9) |
| C13 | 0.0171 (11) | 0.0153 (12) | 0.0202 (13) | 0.0001 (9) | 0.0015 (10) | −0.0016 (10) |
| C14 | 0.0147 (11) | 0.0207 (14) | 0.0307 (15) | 0.0009 (10) | 0.0053 (11) | −0.0064 (11) |
| C15 | 0.0169 (12) | 0.0152 (13) | 0.0370 (16) | 0.0025 (10) | −0.0037 (11) | −0.0022 (11) |
| C16 | 0.0163 (11) | 0.0156 (13) | 0.0258 (14) | −0.0029 (9) | −0.0021 (10) | 0.0026 (10) |
| C17 | 0.0167 (11) | 0.0150 (13) | 0.0246 (14) | 0.0005 (9) | 0.0027 (10) | 0.0017 (10) |
| C18 | 0.0135 (10) | 0.0141 (12) | 0.0139 (11) | 0.0007 (9) | 0.0009 (9) | 0.0028 (9) |
| C19 | 0.0198 (12) | 0.0141 (12) | 0.0155 (12) | −0.0006 (9) | 0.0021 (10) | −0.0006 (9) |
| C20 | 0.0241 (13) | 0.0178 (13) | 0.0219 (14) | −0.0041 (10) | −0.0004 (11) | −0.0023 (11) |
| C21 | 0.0200 (12) | 0.0225 (14) | 0.0274 (15) | −0.0035 (10) | 0.0011 (11) | 0.0070 (11) |
| C22 | 0.0176 (12) | 0.0252 (14) | 0.0241 (14) | 0.0017 (10) | 0.0085 (10) | 0.0047 (11) |
| C23 | 0.0192 (12) | 0.0169 (13) | 0.0177 (12) | 0.0029 (9) | 0.0043 (10) | −0.0006 (10) |
| C24 | 0.0172 (11) | 0.0144 (12) | 0.0205 (13) | −0.0026 (9) | 0.0078 (10) | −0.0042 (10) |
| C25 | 0.0232 (12) | 0.0154 (12) | 0.0228 (13) | −0.0017 (10) | 0.0102 (11) | −0.0009 (10) |
| C26 | 0.0336 (15) | 0.0171 (13) | 0.0324 (16) | −0.0035 (11) | 0.0202 (13) | −0.0031 (12) |
| C27 | 0.0271 (14) | 0.0187 (14) | 0.0449 (18) | −0.0018 (11) | 0.0214 (13) | −0.0050 (13) |
| C28 | 0.0193 (13) | 0.0246 (15) | 0.0414 (18) | 0.0022 (11) | 0.0110 (12) | −0.0066 (13) |
| C29 | 0.0185 (12) | 0.0201 (14) | 0.0269 (14) | 0.0016 (10) | 0.0071 (11) | −0.0026 (11) |
| C30 | 0.0218 (12) | 0.0117 (12) | 0.0155 (12) | −0.0005 (9) | 0.0049 (10) | 0.0000 (9) |
| C31 | 0.0227 (12) | 0.0182 (13) | 0.0202 (13) | 0.0029 (10) | 0.0036 (10) | 0.0003 (10) |
| C32 | 0.0405 (17) | 0.0147 (14) | 0.0269 (15) | 0.0042 (12) | 0.0082 (13) | 0.0040 (11) |
| C33 | 0.0412 (16) | 0.0141 (13) | 0.0201 (13) | −0.0041 (11) | 0.0031 (12) | 0.0013 (10) |
| C34 | 0.0293 (14) | 0.0211 (14) | 0.0201 (14) | −0.0084 (11) | 0.0013 (11) | 0.0005 (11) |
| C35 | 0.0209 (12) | 0.0171 (13) | 0.0144 (12) | 0.0008 (10) | 0.0019 (10) | 0.0000 (10) |
| C36 | 0.0133 (10) | 0.0162 (12) | 0.0159 (12) | 0.0037 (9) | 0.0020 (9) | −0.0018 (9) |
| C37 | 0.0201 (12) | 0.0142 (12) | 0.0190 (12) | 0.0029 (9) | 0.0047 (10) | 0.0008 (10) |
| C38 | 0.0253 (13) | 0.0237 (14) | 0.0155 (12) | 0.0092 (11) | 0.0009 (10) | 0.0033 (10) |
| C39 | 0.0188 (12) | 0.0239 (14) | 0.0161 (12) | 0.0055 (10) | −0.0012 (10) | −0.0037 (10) |
| C40 | 0.0125 (11) | 0.0179 (13) | 0.0197 (13) | 0.0027 (9) | 0.0023 (10) | −0.0036 (9) |
| Pt1—P2 | 2.2575 (6) | C13—H13 | 0.9500 |
| Pt1—P1 | 2.2592 (6) | C14—C15 | 1.385 (4) |
| Pt1—Cl1 | 2.3588 (6) | C14—H14 | 0.9500 |
| Pt1—Cl2 | 2.3592 (6) | C15—C16 | 1.389 (4) |
| Fe1—C5 | 2.007 (2) | C15—H15 | 0.9500 |
| Fe1—C1 | 2.023 (3) | C16—C17 | 1.391 (4) |
| Fe1—C36 | 2.029 (2) | C16—H16 | 0.9500 |
| Fe1—C40 | 2.044 (3) | C17—H17 | 0.9500 |
| Fe1—C37 | 2.045 (3) | C18—C23 | 1.396 (3) |
| Fe1—C4 | 2.053 (3) | C18—C19 | 1.405 (3) |
| Fe1—C2 | 2.058 (2) | C19—C20 | 1.386 (3) |
| Fe1—C39 | 2.066 (3) | C19—H19 | 0.9500 |
| Fe1—C38 | 2.069 (3) | C20—C21 | 1.389 (4) |
| Fe1—C3 | 2.071 (3) | C20—H20 | 0.9500 |
| P1—C5 | 1.797 (2) | C21—C22 | 1.387 (4) |
| P1—C12 | 1.823 (2) | C21—H21 | 0.9500 |
| P1—C18 | 1.827 (2) | C22—C23 | 1.386 (4) |
| P2—C36 | 1.805 (3) | C22—H22 | 0.9500 |
| P2—C24 | 1.823 (2) | C23—H23 | 0.9500 |
| P2—C30 | 1.837 (3) | C24—C25 | 1.395 (4) |
| O1—C8 | 1.227 (4) | C24—C29 | 1.398 (4) |
| O2—C11 | 1.318 (3) | C25—C26 | 1.396 (4) |
| O2—H2 | 0.8400 | C25—H25 | 0.9500 |
| O3—C11 | 1.218 (3) | C26—C27 | 1.377 (4) |
| N1—C8 | 1.354 (3) | C26—H26 | 0.9500 |
| N1—C6 | 1.469 (3) | C27—C28 | 1.382 (4) |
| N1—H1 | 0.8800 | C27—H27 | 0.9500 |
| C1—C2 | 1.418 (4) | C28—C29 | 1.394 (4) |
| C1—C5 | 1.447 (3) | C28—H28 | 0.9500 |
| C1—H1A | 1.0000 | C29—H29 | 0.9500 |
| C2—C3 | 1.412 (4) | C30—C35 | 1.387 (3) |
| C2—H2A | 1.0000 | C30—C31 | 1.395 (4) |
| C3—C4 | 1.426 (4) | C31—C32 | 1.379 (4) |
| C3—H3 | 1.0000 | C31—H31 | 0.9500 |
| C4—C5 | 1.451 (3) | C32—C33 | 1.396 (4) |
| C4—C6 | 1.510 (4) | C32—H32 | 0.9500 |
| C6—C7 | 1.527 (4) | C33—C34 | 1.374 (4) |
| C6—H6 | 1.0000 | C33—H33 | 0.9500 |
| C7—H7A | 0.9800 | C34—C35 | 1.395 (4) |
| C7—H7B | 0.9800 | C34—H34 | 0.9500 |
| C7—H7C | 0.9800 | C35—H35 | 0.9500 |
| C8—C9 | 1.513 (4) | C36—C37 | 1.443 (3) |
| C9—C10 | 1.520 (4) | C36—C40 | 1.445 (3) |
| C9—H9A | 0.9900 | C37—C38 | 1.414 (4) |
| C9—H9B | 0.9900 | C37—H37 | 1.0000 |
| C10—C11 | 1.494 (4) | C38—C39 | 1.420 (4) |
| C10—H10A | 0.9900 | C38—H38 | 1.0000 |
| C10—H10B | 0.9900 | C39—C40 | 1.425 (4) |
| C12—C13 | 1.397 (3) | C39—H39 | 1.0000 |
| C12—C17 | 1.397 (4) | C40—H40 | 1.0000 |
| C13—C14 | 1.391 (4) | ||
| P2—Pt1—P1 | 97.55 (2) | C8—C9—H9B | 109.3 |
| P2—Pt1—Cl1 | 165.62 (2) | C10—C9—H9B | 109.3 |
| P1—Pt1—Cl1 | 90.50 (2) | H9A—C9—H9B | 107.9 |
| P2—Pt1—Cl2 | 86.98 (2) | C11—C10—C9 | 113.2 (2) |
| P1—Pt1—Cl2 | 170.47 (2) | C11—C10—H10A | 108.9 |
| Cl1—Pt1—Cl2 | 86.90 (2) | C9—C10—H10A | 108.9 |
| C5—Fe1—C1 | 42.09 (10) | C11—C10—H10B | 108.9 |
| C5—Fe1—C36 | 108.51 (10) | C9—C10—H10B | 108.9 |
| C1—Fe1—C36 | 134.73 (10) | H10A—C10—H10B | 107.8 |
| C5—Fe1—C40 | 110.79 (10) | O3—C11—O2 | 123.4 (3) |
| C1—Fe1—C40 | 107.39 (10) | O3—C11—C10 | 123.7 (3) |
| C36—Fe1—C40 | 41.56 (10) | O2—C11—C10 | 112.8 (3) |
| C5—Fe1—C37 | 136.80 (10) | C13—C12—C17 | 119.8 (2) |
| C1—Fe1—C37 | 176.16 (10) | C13—C12—P1 | 122.2 (2) |
| C36—Fe1—C37 | 41.49 (10) | C17—C12—P1 | 118.02 (18) |
| C40—Fe1—C37 | 69.19 (10) | C14—C13—C12 | 119.7 (2) |
| C5—Fe1—C4 | 41.86 (9) | C14—C13—H13 | 120.2 |
| C1—Fe1—C4 | 69.79 (10) | C12—C13—H13 | 120.2 |
| C36—Fe1—C4 | 113.55 (10) | C15—C14—C13 | 120.4 (2) |
| C40—Fe1—C4 | 143.12 (11) | C15—C14—H14 | 119.8 |
| C37—Fe1—C4 | 111.75 (10) | C13—C14—H14 | 119.8 |
| C5—Fe1—C2 | 69.55 (10) | C14—C15—C16 | 120.1 (2) |
| C1—Fe1—C2 | 40.66 (10) | C14—C15—H15 | 120.0 |
| C36—Fe1—C2 | 174.72 (11) | C16—C15—H15 | 120.0 |
| C40—Fe1—C2 | 133.95 (11) | C15—C16—C17 | 120.0 (3) |
| C37—Fe1—C2 | 143.05 (11) | C15—C16—H16 | 120.0 |
| C4—Fe1—C2 | 68.53 (10) | C17—C16—H16 | 120.0 |
| C5—Fe1—C39 | 140.90 (11) | C16—C17—C12 | 120.0 (2) |
| C1—Fe1—C39 | 110.79 (11) | C16—C17—H17 | 120.0 |
| C36—Fe1—C39 | 68.87 (10) | C12—C17—H17 | 120.0 |
| C40—Fe1—C39 | 40.57 (10) | C23—C18—C19 | 119.1 (2) |
| C37—Fe1—C39 | 67.93 (10) | C23—C18—P1 | 121.26 (19) |
| C4—Fe1—C39 | 176.24 (11) | C19—C18—P1 | 119.44 (18) |
| C2—Fe1—C39 | 109.33 (11) | C20—C19—C18 | 120.2 (2) |
| C5—Fe1—C38 | 176.98 (11) | C20—C19—H19 | 119.9 |
| C1—Fe1—C38 | 140.86 (11) | C18—C19—H19 | 119.9 |
| C36—Fe1—C38 | 68.88 (10) | C19—C20—C21 | 120.2 (3) |
| C40—Fe1—C38 | 68.42 (11) | C19—C20—H20 | 119.9 |
| C37—Fe1—C38 | 40.20 (10) | C21—C20—H20 | 119.9 |
| C4—Fe1—C38 | 137.27 (11) | C22—C21—C20 | 119.5 (2) |
| C2—Fe1—C38 | 113.19 (11) | C22—C21—H21 | 120.2 |
| C39—Fe1—C38 | 40.16 (11) | C20—C21—H21 | 120.2 |
| C5—Fe1—C3 | 69.11 (10) | C23—C22—C21 | 120.9 (2) |
| C1—Fe1—C3 | 68.23 (10) | C23—C22—H22 | 119.5 |
| C36—Fe1—C3 | 144.53 (10) | C21—C22—H22 | 119.5 |
| C40—Fe1—C3 | 173.90 (11) | C22—C23—C18 | 119.9 (2) |
| C37—Fe1—C3 | 115.32 (10) | C22—C23—H23 | 120.1 |
| C4—Fe1—C3 | 40.45 (10) | C18—C23—H23 | 120.1 |
| C2—Fe1—C3 | 40.00 (10) | C25—C24—C29 | 119.7 (2) |
| C39—Fe1—C3 | 135.99 (11) | C25—C24—P2 | 120.1 (2) |
| C38—Fe1—C3 | 112.01 (11) | C29—C24—P2 | 120.19 (19) |
| C5—P1—C12 | 104.91 (11) | C24—C25—C26 | 119.9 (3) |
| C5—P1—C18 | 106.54 (11) | C24—C25—H25 | 120.1 |
| C12—P1—C18 | 99.63 (11) | C26—C25—H25 | 120.1 |
| C5—P1—Pt1 | 115.84 (8) | C27—C26—C25 | 120.1 (3) |
| C12—P1—Pt1 | 115.01 (8) | C27—C26—H26 | 120.0 |
| C18—P1—Pt1 | 113.28 (8) | C25—C26—H26 | 120.0 |
| C36—P2—C24 | 102.74 (11) | C26—C27—C28 | 120.5 (3) |
| C36—P2—C30 | 99.73 (12) | C26—C27—H27 | 119.8 |
| C24—P2—C30 | 105.64 (11) | C28—C27—H27 | 119.8 |
| C36—P2—Pt1 | 121.32 (8) | C27—C28—C29 | 120.2 (3) |
| C24—P2—Pt1 | 116.02 (9) | C27—C28—H28 | 119.9 |
| C30—P2—Pt1 | 109.28 (8) | C29—C28—H28 | 119.9 |
| C11—O2—H2 | 109.5 | C28—C29—C24 | 119.6 (3) |
| C8—N1—C6 | 124.3 (2) | C28—C29—H29 | 120.2 |
| C8—N1—H1 | 117.8 | C24—C29—H29 | 120.2 |
| C6—N1—H1 | 117.8 | C35—C30—C31 | 119.0 (2) |
| C2—C1—C5 | 108.0 (2) | C35—C30—P2 | 121.66 (19) |
| C2—C1—Fe1 | 70.98 (15) | C31—C30—P2 | 119.2 (2) |
| C5—C1—Fe1 | 68.37 (14) | C32—C31—C30 | 120.4 (3) |
| C2—C1—H1A | 126.0 | C32—C31—H31 | 119.8 |
| C5—C1—H1A | 126.0 | C30—C31—H31 | 119.8 |
| Fe1—C1—H1A | 126.0 | C31—C32—C33 | 120.3 (3) |
| C3—C2—C1 | 108.5 (2) | C31—C32—H32 | 119.8 |
| C3—C2—Fe1 | 70.50 (15) | C33—C32—H32 | 119.8 |
| C1—C2—Fe1 | 68.36 (14) | C34—C33—C32 | 119.7 (3) |
| C3—C2—H2A | 125.8 | C34—C33—H33 | 120.1 |
| C1—C2—H2A | 125.8 | C32—C33—H33 | 120.1 |
| Fe1—C2—H2A | 125.8 | C33—C34—C35 | 120.0 (3) |
| C2—C3—C4 | 109.3 (2) | C33—C34—H34 | 120.0 |
| C2—C3—Fe1 | 69.50 (15) | C35—C34—H34 | 120.0 |
| C4—C3—Fe1 | 69.10 (14) | C30—C35—C34 | 120.6 (2) |
| C2—C3—H3 | 125.3 | C30—C35—H35 | 119.7 |
| C4—C3—H3 | 125.3 | C34—C35—H35 | 119.7 |
| Fe1—C3—H3 | 125.3 | C37—C36—C40 | 107.0 (2) |
| C3—C4—C5 | 107.1 (2) | C37—C36—P2 | 125.56 (19) |
| C3—C4—C6 | 126.5 (2) | C40—C36—P2 | 127.4 (2) |
| C5—C4—C6 | 126.4 (2) | C37—C36—Fe1 | 69.86 (14) |
| C3—C4—Fe1 | 70.45 (15) | C40—C36—Fe1 | 69.76 (14) |
| C5—C4—Fe1 | 67.39 (13) | P2—C36—Fe1 | 127.05 (13) |
| C6—C4—Fe1 | 127.34 (17) | C38—C37—C36 | 108.4 (2) |
| C1—C5—C4 | 107.1 (2) | C38—C37—Fe1 | 70.81 (15) |
| C1—C5—P1 | 126.21 (19) | C36—C37—Fe1 | 68.65 (14) |
| C4—C5—P1 | 126.43 (19) | C38—C37—H37 | 125.8 |
| C1—C5—Fe1 | 69.54 (14) | C36—C37—H37 | 125.8 |
| C4—C5—Fe1 | 70.75 (14) | Fe1—C37—H37 | 125.8 |
| P1—C5—Fe1 | 120.70 (12) | C37—C38—C39 | 108.3 (2) |
| N1—C6—C4 | 111.7 (2) | C37—C38—Fe1 | 68.99 (14) |
| N1—C6—C7 | 111.5 (2) | C39—C38—Fe1 | 69.80 (15) |
| C4—C6—C7 | 113.3 (2) | C37—C38—H38 | 125.8 |
| N1—C6—H6 | 106.6 | C39—C38—H38 | 125.8 |
| C4—C6—H6 | 106.6 | Fe1—C38—H38 | 125.8 |
| C7—C6—H6 | 106.6 | C38—C39—C40 | 108.7 (2) |
| C6—C7—H7A | 109.5 | C38—C39—Fe1 | 70.03 (15) |
| C6—C7—H7B | 109.5 | C40—C39—Fe1 | 68.86 (15) |
| H7A—C7—H7B | 109.5 | C38—C39—H39 | 125.6 |
| C6—C7—H7C | 109.5 | C40—C39—H39 | 125.6 |
| H7A—C7—H7C | 109.5 | Fe1—C39—H39 | 125.6 |
| H7B—C7—H7C | 109.5 | C39—C40—C36 | 107.6 (2) |
| O1—C8—N1 | 122.8 (3) | C39—C40—Fe1 | 70.56 (15) |
| O1—C8—C9 | 122.4 (3) | C36—C40—Fe1 | 68.68 (14) |
| N1—C8—C9 | 114.8 (3) | C39—C40—H40 | 126.2 |
| C8—C9—C10 | 111.8 (3) | C36—C40—H40 | 126.2 |
| C8—C9—H9A | 109.3 | Fe1—C40—H40 | 126.2 |
| C10—C9—H9A | 109.3 | ||
| P2—Pt1—P1—C5 | 55.66 (9) | Pt1—P1—C12—C17 | 65.6 (2) |
| Cl1—Pt1—P1—C5 | −112.39 (9) | C17—C12—C13—C14 | 1.4 (4) |
| Cl2—Pt1—P1—C5 | 173.58 (14) | P1—C12—C13—C14 | −175.5 (2) |
| P2—Pt1—P1—C12 | 178.43 (9) | C12—C13—C14—C15 | 0.3 (4) |
| Cl1—Pt1—P1—C12 | 10.38 (9) | C13—C14—C15—C16 | −2.0 (4) |
| Cl2—Pt1—P1—C12 | −63.65 (16) | C14—C15—C16—C17 | 2.0 (4) |
| P2—Pt1—P1—C18 | −67.88 (9) | C15—C16—C17—C12 | −0.4 (4) |
| Cl1—Pt1—P1—C18 | 124.06 (9) | C13—C12—C17—C16 | −1.3 (4) |
| Cl2—Pt1—P1—C18 | 50.04 (16) | P1—C12—C17—C16 | 175.7 (2) |
| P1—Pt1—P2—C36 | −20.67 (10) | C5—P1—C18—C23 | −126.6 (2) |
| Cl1—Pt1—P2—C36 | 102.85 (13) | C12—P1—C18—C23 | 124.6 (2) |
| Cl2—Pt1—P2—C36 | 167.75 (10) | Pt1—P1—C18—C23 | 2.0 (2) |
| P1—Pt1—P2—C24 | 105.09 (9) | C5—P1—C18—C19 | 58.4 (2) |
| Cl1—Pt1—P2—C24 | −131.39 (12) | C12—P1—C18—C19 | −50.4 (2) |
| Cl2—Pt1—P2—C24 | −66.49 (9) | Pt1—P1—C18—C19 | −173.11 (17) |
| P1—Pt1—P2—C30 | −135.66 (8) | C23—C18—C19—C20 | 4.2 (4) |
| Cl1—Pt1—P2—C30 | −12.14 (13) | P1—C18—C19—C20 | 179.4 (2) |
| Cl2—Pt1—P2—C30 | 52.76 (8) | C18—C19—C20—C21 | −3.0 (4) |
| C5—Fe1—C1—C2 | −119.3 (2) | C19—C20—C21—C22 | −0.2 (4) |
| C36—Fe1—C1—C2 | 176.22 (15) | C20—C21—C22—C23 | 2.2 (4) |
| C40—Fe1—C1—C2 | 138.72 (16) | C21—C22—C23—C18 | −1.0 (4) |
| C37—Fe1—C1—C2 | 165.6 (15) | C19—C18—C23—C22 | −2.2 (4) |
| C4—Fe1—C1—C2 | −80.21 (16) | P1—C18—C23—C22 | −177.3 (2) |
| C39—Fe1—C1—C2 | 95.82 (16) | C36—P2—C24—C25 | 155.4 (2) |
| C38—Fe1—C1—C2 | 61.8 (2) | C30—P2—C24—C25 | −100.5 (2) |
| C3—Fe1—C1—C2 | −36.78 (15) | Pt1—P2—C24—C25 | 20.7 (2) |
| C36—Fe1—C1—C5 | −64.51 (19) | C36—P2—C24—C29 | −28.0 (2) |
| C40—Fe1—C1—C5 | −102.00 (15) | C30—P2—C24—C29 | 76.1 (2) |
| C37—Fe1—C1—C5 | −75.2 (16) | Pt1—P2—C24—C29 | −162.68 (18) |
| C4—Fe1—C1—C5 | 39.06 (14) | C29—C24—C25—C26 | −2.4 (4) |
| C2—Fe1—C1—C5 | 119.3 (2) | P2—C24—C25—C26 | 174.2 (2) |
| C39—Fe1—C1—C5 | −144.91 (14) | C24—C25—C26—C27 | 1.0 (4) |
| C38—Fe1—C1—C5 | −178.95 (16) | C25—C26—C27—C28 | 0.1 (4) |
| C3—Fe1—C1—C5 | 82.50 (15) | C26—C27—C28—C29 | 0.1 (4) |
| C5—C1—C2—C3 | 0.8 (3) | C27—C28—C29—C24 | −1.5 (4) |
| Fe1—C1—C2—C3 | 59.27 (18) | C25—C24—C29—C28 | 2.6 (4) |
| C5—C1—C2—Fe1 | −58.51 (16) | P2—C24—C29—C28 | −174.0 (2) |
| C5—Fe1—C2—C3 | −81.51 (16) | C36—P2—C30—C35 | −111.1 (2) |
| C1—Fe1—C2—C3 | −120.1 (2) | C24—P2—C30—C35 | 142.7 (2) |
| C36—Fe1—C2—C3 | −150.8 (11) | Pt1—P2—C30—C35 | 17.2 (2) |
| C40—Fe1—C2—C3 | 178.90 (16) | C36—P2—C30—C31 | 64.5 (2) |
| C37—Fe1—C2—C3 | 61.5 (2) | C24—P2—C30—C31 | −41.8 (2) |
| C4—Fe1—C2—C3 | −36.54 (15) | Pt1—P2—C30—C31 | −167.27 (18) |
| C39—Fe1—C2—C3 | 140.16 (16) | C35—C30—C31—C32 | −0.4 (4) |
| C38—Fe1—C2—C3 | 97.11 (17) | P2—C30—C31—C32 | −176.1 (2) |
| C5—Fe1—C2—C1 | 38.61 (15) | C30—C31—C32—C33 | 0.2 (4) |
| C36—Fe1—C2—C1 | −30.6 (12) | C31—C32—C33—C34 | 0.5 (4) |
| C40—Fe1—C2—C1 | −61.0 (2) | C32—C33—C34—C35 | −1.1 (4) |
| C37—Fe1—C2—C1 | −178.41 (17) | C31—C30—C35—C34 | −0.1 (4) |
| C4—Fe1—C2—C1 | 83.58 (16) | P2—C30—C35—C34 | 175.5 (2) |
| C39—Fe1—C2—C1 | −99.72 (16) | C33—C34—C35—C30 | 0.8 (4) |
| C38—Fe1—C2—C1 | −142.77 (15) | C24—P2—C36—C37 | 123.0 (2) |
| C3—Fe1—C2—C1 | 120.1 (2) | C30—P2—C36—C37 | 14.4 (2) |
| C1—C2—C3—C4 | −0.3 (3) | Pt1—P2—C36—C37 | −105.3 (2) |
| Fe1—C2—C3—C4 | 57.70 (18) | C24—P2—C36—C40 | −54.6 (2) |
| C1—C2—C3—Fe1 | −57.96 (17) | C30—P2—C36—C40 | −163.2 (2) |
| C5—Fe1—C3—C2 | 82.70 (17) | Pt1—P2—C36—C40 | 77.0 (2) |
| C1—Fe1—C3—C2 | 37.37 (15) | C24—P2—C36—Fe1 | −146.42 (16) |
| C36—Fe1—C3—C2 | 175.56 (17) | C30—P2—C36—Fe1 | 104.96 (17) |
| C40—Fe1—C3—C2 | −7.5 (11) | Pt1—P2—C36—Fe1 | −14.8 (2) |
| C37—Fe1—C3—C2 | −144.25 (16) | C5—Fe1—C36—C37 | 141.43 (15) |
| C4—Fe1—C3—C2 | 121.3 (2) | C1—Fe1—C36—C37 | −178.93 (15) |
| C39—Fe1—C3—C2 | −60.5 (2) | C40—Fe1—C36—C37 | −117.8 (2) |
| C38—Fe1—C3—C2 | −100.31 (17) | C4—Fe1—C36—C37 | 96.73 (15) |
| C5—Fe1—C3—C4 | −38.64 (14) | C2—Fe1—C36—C37 | −151.1 (11) |
| C1—Fe1—C3—C4 | −83.98 (16) | C39—Fe1—C36—C37 | −80.15 (16) |
| C36—Fe1—C3—C4 | 54.2 (2) | C38—Fe1—C36—C37 | −36.95 (15) |
| C40—Fe1—C3—C4 | −128.8 (10) | C3—Fe1—C36—C37 | 61.7 (2) |
| C37—Fe1—C3—C4 | 94.40 (16) | C5—Fe1—C36—C40 | −100.75 (16) |
| C2—Fe1—C3—C4 | −121.3 (2) | C1—Fe1—C36—C40 | −61.1 (2) |
| C39—Fe1—C3—C4 | 178.17 (16) | C37—Fe1—C36—C40 | 117.8 (2) |
| C38—Fe1—C3—C4 | 138.34 (15) | C4—Fe1—C36—C40 | −145.45 (15) |
| C2—C3—C4—C5 | −0.3 (3) | C2—Fe1—C36—C40 | −33.2 (12) |
| Fe1—C3—C4—C5 | 57.59 (16) | C39—Fe1—C36—C40 | 37.67 (15) |
| C2—C3—C4—C6 | 179.5 (2) | C38—Fe1—C36—C40 | 80.86 (16) |
| Fe1—C3—C4—C6 | −122.6 (2) | C3—Fe1—C36—C40 | 179.51 (18) |
| C2—C3—C4—Fe1 | −57.94 (19) | C5—Fe1—C36—P2 | 21.49 (19) |
| C5—Fe1—C4—C3 | 119.0 (2) | C1—Fe1—C36—P2 | 61.1 (2) |
| C1—Fe1—C4—C3 | 79.78 (16) | C40—Fe1—C36—P2 | 122.2 (2) |
| C36—Fe1—C4—C3 | −149.10 (15) | C37—Fe1—C36—P2 | −119.9 (2) |
| C40—Fe1—C4—C3 | 172.08 (17) | C4—Fe1—C36—P2 | −23.2 (2) |
| C37—Fe1—C4—C3 | −104.00 (16) | C2—Fe1—C36—P2 | 89.0 (11) |
| C2—Fe1—C4—C3 | 36.15 (15) | C39—Fe1—C36—P2 | 159.9 (2) |
| C39—Fe1—C4—C3 | −19.7 (16) | C38—Fe1—C36—P2 | −156.9 (2) |
| C38—Fe1—C4—C3 | −65.3 (2) | C3—Fe1—C36—P2 | −58.2 (3) |
| C1—Fe1—C4—C5 | −39.27 (14) | C40—C36—C37—C38 | −0.3 (3) |
| C36—Fe1—C4—C5 | 91.86 (16) | P2—C36—C37—C38 | −178.37 (18) |
| C40—Fe1—C4—C5 | 53.0 (2) | Fe1—C36—C37—C38 | 59.85 (17) |
| C37—Fe1—C4—C5 | 136.96 (14) | C40—C36—C37—Fe1 | −60.18 (16) |
| C2—Fe1—C4—C5 | −82.89 (15) | P2—C36—C37—Fe1 | 121.78 (19) |
| C39—Fe1—C4—C5 | −138.8 (16) | C5—Fe1—C37—C38 | −179.41 (16) |
| C38—Fe1—C4—C5 | 175.69 (15) | C1—Fe1—C37—C38 | −108.3 (16) |
| C3—Fe1—C4—C5 | −119.0 (2) | C36—Fe1—C37—C38 | −119.7 (2) |
| C5—Fe1—C4—C6 | −119.4 (3) | C40—Fe1—C37—C38 | −80.80 (17) |
| C1—Fe1—C4—C6 | −158.7 (2) | C4—Fe1—C37—C38 | 138.88 (16) |
| C36—Fe1—C4—C6 | −27.5 (3) | C2—Fe1—C37—C38 | 56.1 (2) |
| C40—Fe1—C4—C6 | −66.4 (3) | C39—Fe1—C37—C38 | −37.08 (16) |
| C37—Fe1—C4—C6 | 17.6 (3) | C3—Fe1—C37—C38 | 94.74 (17) |
| C2—Fe1—C4—C6 | 157.7 (3) | C5—Fe1—C37—C36 | −59.7 (2) |
| C39—Fe1—C4—C6 | 101.8 (16) | C1—Fe1—C37—C36 | 11.4 (16) |
| C38—Fe1—C4—C6 | 56.3 (3) | C40—Fe1—C37—C36 | 38.88 (14) |
| C3—Fe1—C4—C6 | 121.6 (3) | C4—Fe1—C37—C36 | −101.44 (15) |
| C2—C1—C5—C4 | −1.0 (3) | C2—Fe1—C37—C36 | 175.76 (17) |
| Fe1—C1—C5—C4 | −61.11 (16) | C39—Fe1—C37—C36 | 82.60 (16) |
| C2—C1—C5—P1 | 173.86 (18) | C38—Fe1—C37—C36 | 119.7 (2) |
| Fe1—C1—C5—P1 | 113.71 (19) | C3—Fe1—C37—C36 | −145.58 (15) |
| C2—C1—C5—Fe1 | 60.14 (17) | C36—C37—C38—C39 | 0.4 (3) |
| C3—C4—C5—C1 | 0.8 (3) | Fe1—C37—C38—C39 | 58.91 (18) |
| C6—C4—C5—C1 | −179.1 (2) | C36—C37—C38—Fe1 | −58.52 (17) |
| Fe1—C4—C5—C1 | 60.33 (16) | C5—Fe1—C38—C37 | 8(2) |
| C3—C4—C5—P1 | −174.00 (18) | C1—Fe1—C38—C37 | 174.21 (16) |
| C6—C4—C5—P1 | 6.1 (4) | C36—Fe1—C38—C37 | 38.10 (15) |
| Fe1—C4—C5—P1 | −114.48 (19) | C40—Fe1—C38—C37 | 82.88 (16) |
| C3—C4—C5—Fe1 | −59.53 (17) | C4—Fe1—C38—C37 | −64.2 (2) |
| C6—C4—C5—Fe1 | 120.6 (2) | C2—Fe1—C38—C37 | −147.14 (15) |
| C12—P1—C5—C1 | 87.3 (2) | C39—Fe1—C38—C37 | 120.0 (2) |
| C18—P1—C5—C1 | −17.7 (2) | C3—Fe1—C38—C37 | −103.67 (16) |
| Pt1—P1—C5—C1 | −144.74 (18) | C5—Fe1—C38—C39 | −112 (2) |
| C12—P1—C5—C4 | −98.8 (2) | C1—Fe1—C38—C39 | 54.3 (2) |
| C18—P1—C5—C4 | 156.1 (2) | C36—Fe1—C38—C39 | −81.86 (16) |
| Pt1—P1—C5—C4 | 29.1 (2) | C40—Fe1—C38—C39 | −37.08 (15) |
| C12—P1—C5—Fe1 | 173.35 (13) | C37—Fe1—C38—C39 | −120.0 (2) |
| C18—P1—C5—Fe1 | 68.30 (16) | C4—Fe1—C38—C39 | 175.84 (16) |
| Pt1—P1—C5—Fe1 | −58.70 (15) | C2—Fe1—C38—C39 | 92.90 (17) |
| C36—Fe1—C5—C1 | 137.46 (14) | C3—Fe1—C38—C39 | 136.37 (16) |
| C40—Fe1—C5—C1 | 93.26 (15) | C37—C38—C39—C40 | −0.3 (3) |
| C37—Fe1—C5—C1 | 174.57 (15) | Fe1—C38—C39—C40 | 58.11 (18) |
| C4—Fe1—C5—C1 | −117.6 (2) | C37—C38—C39—Fe1 | −58.41 (17) |
| C2—Fe1—C5—C1 | −37.34 (14) | C5—Fe1—C39—C38 | 175.56 (16) |
| C39—Fe1—C5—C1 | 58.5 (2) | C1—Fe1—C39—C38 | −146.77 (15) |
| C38—Fe1—C5—C1 | 167.4 (19) | C36—Fe1—C39—C38 | 81.90 (16) |
| C3—Fe1—C5—C1 | −80.22 (15) | C40—Fe1—C39—C38 | 120.5 (2) |
| C1—Fe1—C5—C4 | 117.6 (2) | C37—Fe1—C39—C38 | 37.12 (15) |
| C36—Fe1—C5—C4 | −104.94 (15) | C4—Fe1—C39—C38 | −48.7 (16) |
| C40—Fe1—C5—C4 | −149.14 (15) | C2—Fe1—C39—C38 | −103.39 (16) |
| C37—Fe1—C5—C4 | −67.83 (19) | C3—Fe1—C39—C38 | −67.0 (2) |
| C2—Fe1—C5—C4 | 80.26 (15) | C5—Fe1—C39—C40 | 55.1 (2) |
| C39—Fe1—C5—C4 | 176.07 (16) | C1—Fe1—C39—C40 | 92.77 (16) |
| C38—Fe1—C5—C4 | −75 (2) | C36—Fe1—C39—C40 | −38.56 (15) |
| C3—Fe1—C5—C4 | 37.38 (15) | C37—Fe1—C39—C40 | −83.34 (16) |
| C1—Fe1—C5—P1 | −120.8 (2) | C4—Fe1—C39—C40 | −169.1 (15) |
| C36—Fe1—C5—P1 | 16.67 (17) | C2—Fe1—C39—C40 | 136.16 (15) |
| C40—Fe1—C5—P1 | −27.53 (18) | C38—Fe1—C39—C40 | −120.5 (2) |
| C37—Fe1—C5—P1 | 53.8 (2) | C3—Fe1—C39—C40 | 172.51 (15) |
| C4—Fe1—C5—P1 | 121.6 (2) | C38—C39—C40—C36 | 0.1 (3) |
| C2—Fe1—C5—P1 | −158.13 (18) | Fe1—C39—C40—C36 | 58.92 (16) |
| C39—Fe1—C5—P1 | −62.3 (2) | C38—C39—C40—Fe1 | −58.82 (18) |
| C38—Fe1—C5—P1 | 47 (2) | C37—C36—C40—C39 | 0.1 (3) |
| C3—Fe1—C5—P1 | 158.99 (18) | P2—C36—C40—C39 | 178.13 (18) |
| C8—N1—C6—C4 | 63.6 (3) | Fe1—C36—C40—C39 | −60.11 (17) |
| C8—N1—C6—C7 | −64.3 (3) | C37—C36—C40—Fe1 | 60.24 (16) |
| C3—C4—C6—N1 | −113.9 (3) | P2—C36—C40—Fe1 | −121.8 (2) |
| C5—C4—C6—N1 | 65.9 (3) | C5—Fe1—C40—C39 | −146.41 (15) |
| Fe1—C4—C6—N1 | 153.75 (18) | C1—Fe1—C40—C39 | −101.88 (16) |
| C3—C4—C6—C7 | 13.0 (4) | C36—Fe1—C40—C39 | 118.8 (2) |
| C5—C4—C6—C7 | −167.2 (2) | C37—Fe1—C40—C39 | 79.97 (16) |
| Fe1—C4—C6—C7 | −79.4 (3) | C4—Fe1—C40—C39 | 178.82 (17) |
| C6—N1—C8—O1 | −2.0 (4) | C2—Fe1—C40—C39 | −65.2 (2) |
| C6—N1—C8—C9 | 177.1 (2) | C38—Fe1—C40—C39 | 36.72 (16) |
| O1—C8—C9—C10 | 20.2 (4) | C3—Fe1—C40—C39 | −58.5 (11) |
| N1—C8—C9—C10 | −158.9 (2) | C5—Fe1—C40—C36 | 94.80 (16) |
| C8—C9—C10—C11 | −82.7 (3) | C1—Fe1—C40—C36 | 139.32 (15) |
| C9—C10—C11—O3 | −21.9 (4) | C37—Fe1—C40—C36 | −38.82 (14) |
| C9—C10—C11—O2 | 160.6 (3) | C4—Fe1—C40—C36 | 60.0 (2) |
| C5—P1—C12—C13 | 11.0 (2) | C2—Fe1—C40—C36 | 175.99 (15) |
| C18—P1—C12—C13 | 121.1 (2) | C39—Fe1—C40—C36 | −118.8 (2) |
| Pt1—P1—C12—C13 | −117.5 (2) | C38—Fe1—C40—C36 | −82.07 (16) |
| C5—P1—C12—C17 | −165.9 (2) | C3—Fe1—C40—C36 | −177.3 (10) |
| C18—P1—C12—C17 | −55.8 (2) |
| H··· | ||||
| O2—H2···O3i | 0.84 | 1.82 | 2.656 (3) | 177 |
| N1—H1···Cl1 | 0.88 | 2.69 | 3.477 (2) | 150 |
Selected bond lengths (Å)
| Pt1—P2 | 2.2575 (6) |
| Pt1—P1 | 2.2592 (6) |
| Pt1—Cl1 | 2.3588 (6) |
| Pt1—Cl2 | 2.3592 (6) |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| O2—H2⋯O3i | 0.84 | 1.82 | 2.656 (3) | 177 |
| N1—H1⋯Cl1 | 0.88 | 2.69 | 3.477 (2) | 150 |
Symmetry code: (i) .