| Literature DB >> 21588210 |
Yi Guo1, Jianfeng Wang, Chixiao Zhang, Shuping Luo.
Abstract
The title compound, [Fe(2)(C(5)H(5))(2)(C(26)H(26)N(2))], was synthesized from a chiral diamine and ferrocenecarboxaldehyde and subsequent reduction with NaBH(4). It has two chiral centers which both exhibit an R configuration. Two ferrocene groups are present in the mol-ecular structure, with their cyclo-penta-dienyl ring planes showing an almost perpen-dicular arrangement [dihedral angle 88.6 (1)°].Entities:
Year: 2010 PMID: 21588210 PMCID: PMC3007283 DOI: 10.1107/S1600536810024293
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Fe2(C5H5)2(C26H26N2)] | |
| Orthorhombic, | Mo |
| Hall symbol: P 2ac 2ab | Cell parameters from 36065 reflections |
| θ = 3.0–27.4° | |
| µ = 1.01 mm−1 | |
| Chunk, yellow | |
| 0.36 × 0.20 × 0.18 mm |
| Rigaku R-AXIS RAPID/ZJUG diffractometer | 6726 independent reflections |
| Radiation source: rolling anode | 5515 reflections with |
| graphite | |
| Detector resolution: 10.00 pixels mm-1 | θmax = 27.4°, θmin = 3.0° |
| ω scans | |
| Absorption correction: multi-scan ( | |
| 45235 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 | |
| 6726 reflections | Δρmax = 0.37 e Å−3 |
| 361 parameters | Δρmin = −0.23 e Å−3 |
| 30 restraints | Absolute structure: Flack (1983), 2915 Friedel pairs |
| Primary atom site location: structure-invariant direct methods | Flack parameter: −0.006 (14) |
| 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 |
| Fe1 | 0.43233 (3) | 0.37036 (4) | 0.323961 (10) | 0.04776 (9) | |
| Fe2 | 0.94810 (3) | 0.90157 (4) | 0.321361 (10) | 0.04747 (9) | |
| N2 | 0.9684 (2) | 0.5571 (2) | 0.41297 (5) | 0.0485 (5) | |
| H102 | 0.9423 | 0.5072 | 0.3922 | 0.058* | |
| N1 | 0.7154 (2) | 0.4016 (2) | 0.40061 (6) | 0.0503 (5) | |
| H101 | 0.6563 | 0.4670 | 0.3950 | 0.060* | |
| C3 | 0.6747 (2) | 0.4068 (3) | 0.47784 (7) | 0.0452 (5) | |
| C2 | 0.8515 (2) | 0.5632 (3) | 0.44242 (6) | 0.0409 (5) | |
| H2 | 0.7853 | 0.6356 | 0.4335 | 0.049* | |
| C1 | 0.7758 (2) | 0.4207 (3) | 0.44201 (6) | 0.0425 (5) | |
| H1 | 0.8481 | 0.3486 | 0.4456 | 0.051* | |
| C9 | 0.9024 (2) | 0.5980 (2) | 0.48587 (6) | 0.0401 (5) | |
| C8 | 0.7111 (3) | 0.3287 (3) | 0.51228 (8) | 0.0598 (7) | |
| H8 | 0.7931 | 0.2757 | 0.5121 | 0.072* | |
| C14 | 1.0251 (3) | 0.5382 (3) | 0.50131 (7) | 0.0500 (6) | |
| H14 | 1.0819 | 0.4847 | 0.4841 | 0.060* | |
| C15 | 0.6487 (3) | 0.2668 (3) | 0.39368 (8) | 0.0548 (6) | |
| H15A | 0.5734 | 0.2541 | 0.4135 | 0.066* | |
| H15B | 0.7172 | 0.1930 | 0.3980 | 0.066* | |
| C26 | 1.0090 (2) | 0.6932 (3) | 0.39546 (7) | 0.0471 (5) | |
| H26A | 1.1022 | 0.6851 | 0.3835 | 0.057* | |
| H26B | 1.0139 | 0.7613 | 0.4176 | 0.057* | |
| C10 | 0.8224 (3) | 0.6798 (3) | 0.51214 (8) | 0.0521 (6) | |
| H10 | 0.7415 | 0.7229 | 0.5023 | 0.063* | |
| C31 | 0.8056 (2) | 0.8517 (3) | 0.36615 (8) | 0.0549 (6) | |
| H31 | 0.7851 | 0.9072 | 0.3909 | 0.066* | |
| C16 | 0.5904 (3) | 0.2557 (3) | 0.35076 (7) | 0.0508 (6) | |
| C27 | 0.9096 (2) | 0.7459 (2) | 0.36297 (6) | 0.0422 (5) | |
| C13 | 1.0632 (3) | 0.5577 (3) | 0.54203 (8) | 0.0601 (7) | |
| H13 | 1.1450 | 0.5166 | 0.5520 | 0.072* | |
| C12 | 0.9821 (3) | 0.6369 (4) | 0.56794 (8) | 0.0678 (8) | |
| H12 | 1.0083 | 0.6489 | 0.5954 | 0.081* | |
| C28 | 0.9022 (3) | 0.6931 (3) | 0.32162 (7) | 0.0543 (6) | |
| H28 | 0.9614 | 0.6189 | 0.3101 | 0.065* | |
| C11 | 0.8618 (3) | 0.6985 (3) | 0.55323 (9) | 0.0652 (8) | |
| H11 | 0.8066 | 0.7527 | 0.5707 | 0.078* | |
| C4 | 0.5492 (3) | 0.4811 (3) | 0.47917 (8) | 0.0598 (6) | |
| H4 | 0.5218 | 0.5326 | 0.4562 | 0.072* | |
| C6 | 0.5039 (4) | 0.4050 (4) | 0.54768 (10) | 0.0793 (10) | |
| H6 | 0.4477 | 0.4053 | 0.5712 | 0.095* | |
| C20 | 0.4766 (3) | 0.1674 (3) | 0.33873 (9) | 0.0592 (7) | |
| H20 | 0.4212 | 0.1076 | 0.3572 | 0.071* | |
| C17 | 0.6403 (3) | 0.3242 (3) | 0.31475 (8) | 0.0614 (7) | |
| H17 | 0.7176 | 0.3918 | 0.3136 | 0.074* | |
| C29 | 0.7979 (3) | 0.7670 (4) | 0.30013 (9) | 0.0698 (9) | |
| H29 | 0.7720 | 0.7531 | 0.2711 | 0.084* | |
| C32 | 1.1195 (4) | 1.0080 (4) | 0.34107 (11) | 0.0839 (10) | |
| H32 | 1.1612 | 1.0017 | 0.3687 | 0.101* | |
| C5 | 0.4645 (3) | 0.4805 (3) | 0.51363 (10) | 0.0715 (8) | |
| H5 | 0.3809 | 0.5311 | 0.5138 | 0.086* | |
| C30 | 0.7372 (3) | 0.8646 (3) | 0.32714 (10) | 0.0702 (8) | |
| H30 | 0.6614 | 0.9302 | 0.3204 | 0.084* | |
| C24 | 0.2309 (3) | 0.4341 (4) | 0.31180 (11) | 0.0801 (9) | |
| H24 | 0.1606 | 0.3797 | 0.2966 | 0.096* | |
| C18 | 0.5570 (3) | 0.2791 (4) | 0.28069 (8) | 0.0732 (9) | |
| H18 | 0.5676 | 0.3094 | 0.2519 | 0.088* | |
| C19 | 0.4575 (3) | 0.1810 (3) | 0.29560 (9) | 0.0710 (8) | |
| H19 | 0.3866 | 0.1324 | 0.2790 | 0.085* | |
| C7 | 0.6253 (4) | 0.3293 (4) | 0.54704 (9) | 0.0785 (9) | |
| H7 | 0.6511 | 0.2775 | 0.5701 | 0.094* | |
| C23 | 0.3212 (4) | 0.5237 (4) | 0.29493 (11) | 0.0834 (10) | |
| H23 | 0.3270 | 0.5443 | 0.2653 | 0.100* | |
| C25 | 0.2527 (4) | 0.4278 (5) | 0.35312 (12) | 0.0930 (12) | |
| H25 | 0.1993 | 0.3707 | 0.3728 | 0.112* | |
| C35 | 1.0710 (4) | 0.9670 (4) | 0.27345 (10) | 0.0883 (11) | |
| H35 | 1.0729 | 0.9273 | 0.2456 | 0.106* | |
| C33 | 1.0145 (4) | 1.1026 (4) | 0.32899 (12) | 0.0847 (10) | |
| H33 | 0.9704 | 1.1742 | 0.3463 | 0.102* | |
| C34 | 0.9860 (4) | 1.0758 (4) | 0.28695 (11) | 0.0871 (10) | |
| H34 | 0.9163 | 1.1252 | 0.2701 | 0.104* | |
| C21 | 0.3648 (5) | 0.5201 (5) | 0.36307 (12) | 0.1072 (15) | |
| H21 | 0.4018 | 0.5418 | 0.3906 | 0.129* | |
| C36 | 1.1550 (3) | 0.9248 (5) | 0.30731 (13) | 0.0906 (12) | |
| H36 | 1.2259 | 0.8504 | 0.3070 | 0.109* | |
| C22 | 0.4070 (4) | 0.5806 (4) | 0.32431 (17) | 0.1047 (13) | |
| H22 | 0.4802 | 0.6512 | 0.3200 | 0.126* |
| Fe1 | 0.05325 (19) | 0.04715 (19) | 0.04286 (16) | 0.00223 (15) | 0.00165 (15) | −0.00436 (15) |
| Fe2 | 0.04937 (17) | 0.0520 (2) | 0.04101 (16) | −0.00561 (15) | 0.00362 (15) | 0.00793 (15) |
| N2 | 0.0538 (11) | 0.0516 (12) | 0.0402 (10) | 0.0026 (9) | 0.0066 (9) | 0.0041 (8) |
| N1 | 0.0605 (11) | 0.0488 (12) | 0.0416 (10) | −0.0036 (10) | −0.0095 (9) | 0.0006 (9) |
| C3 | 0.0511 (12) | 0.0417 (13) | 0.0426 (11) | −0.0078 (10) | −0.0028 (9) | 0.0007 (10) |
| C2 | 0.0410 (11) | 0.0424 (13) | 0.0395 (11) | 0.0026 (9) | −0.0006 (9) | 0.0067 (9) |
| C1 | 0.0450 (11) | 0.0431 (13) | 0.0393 (11) | 0.0010 (10) | −0.0028 (9) | 0.0029 (9) |
| C9 | 0.0372 (10) | 0.0403 (12) | 0.0427 (11) | −0.0056 (9) | 0.0007 (9) | 0.0022 (9) |
| C8 | 0.0799 (18) | 0.0500 (16) | 0.0495 (14) | 0.0002 (14) | 0.0017 (13) | 0.0085 (12) |
| C14 | 0.0457 (13) | 0.0517 (15) | 0.0528 (14) | 0.0016 (11) | −0.0024 (10) | 0.0005 (11) |
| C15 | 0.0597 (15) | 0.0459 (15) | 0.0588 (14) | −0.0028 (11) | −0.0106 (12) | −0.0009 (12) |
| C26 | 0.0458 (12) | 0.0544 (15) | 0.0413 (11) | −0.0063 (10) | 0.0005 (10) | 0.0051 (10) |
| C10 | 0.0434 (12) | 0.0559 (16) | 0.0572 (14) | 0.0022 (11) | −0.0015 (11) | −0.0082 (12) |
| C31 | 0.0498 (13) | 0.0582 (17) | 0.0565 (14) | −0.0026 (12) | 0.0170 (11) | 0.0018 (12) |
| C16 | 0.0503 (14) | 0.0485 (14) | 0.0535 (13) | 0.0061 (11) | −0.0017 (11) | −0.0110 (11) |
| C27 | 0.0425 (12) | 0.0466 (13) | 0.0374 (10) | −0.0068 (10) | 0.0061 (9) | 0.0022 (9) |
| C13 | 0.0526 (14) | 0.0753 (18) | 0.0523 (13) | −0.0063 (14) | −0.0145 (13) | 0.0087 (12) |
| C12 | 0.0673 (17) | 0.090 (2) | 0.0458 (14) | −0.0214 (16) | −0.0069 (12) | −0.0039 (14) |
| C28 | 0.0700 (15) | 0.0517 (14) | 0.0412 (11) | −0.0092 (12) | −0.0013 (12) | −0.0028 (12) |
| C11 | 0.0606 (17) | 0.075 (2) | 0.0603 (16) | −0.0106 (15) | 0.0087 (14) | −0.0234 (15) |
| C4 | 0.0498 (14) | 0.0714 (18) | 0.0582 (14) | 0.0008 (13) | −0.0009 (13) | 0.0028 (12) |
| C6 | 0.091 (2) | 0.076 (2) | 0.0701 (19) | −0.0240 (19) | 0.0350 (17) | −0.0107 (17) |
| C20 | 0.0592 (15) | 0.0398 (14) | 0.0786 (17) | 0.0041 (11) | −0.0131 (13) | −0.0091 (12) |
| C17 | 0.0529 (14) | 0.078 (2) | 0.0527 (15) | 0.0027 (13) | 0.0100 (12) | −0.0141 (14) |
| C29 | 0.0742 (19) | 0.084 (2) | 0.0510 (15) | −0.0227 (17) | −0.0184 (14) | 0.0103 (15) |
| C32 | 0.0736 (19) | 0.105 (3) | 0.0736 (19) | −0.0429 (19) | −0.0034 (16) | 0.0102 (19) |
| C5 | 0.0549 (17) | 0.080 (2) | 0.0794 (18) | −0.0115 (15) | 0.0153 (15) | −0.0085 (16) |
| C30 | 0.0423 (12) | 0.083 (2) | 0.086 (2) | −0.0008 (13) | −0.0033 (14) | 0.0305 (19) |
| C24 | 0.0648 (17) | 0.080 (2) | 0.096 (3) | 0.0132 (17) | −0.0069 (17) | 0.0020 (19) |
| C18 | 0.0751 (19) | 0.096 (2) | 0.0483 (14) | 0.0130 (19) | 0.0027 (15) | −0.0240 (14) |
| C19 | 0.0755 (19) | 0.0642 (19) | 0.0734 (18) | 0.0088 (17) | −0.0200 (16) | −0.0295 (15) |
| C7 | 0.117 (3) | 0.067 (2) | 0.0517 (15) | −0.013 (2) | 0.0089 (17) | 0.0135 (14) |
| C23 | 0.091 (2) | 0.079 (3) | 0.080 (2) | 0.013 (2) | 0.0009 (19) | 0.0228 (19) |
| C25 | 0.096 (2) | 0.097 (3) | 0.086 (2) | 0.045 (2) | 0.039 (2) | 0.023 (2) |
| C35 | 0.103 (3) | 0.100 (3) | 0.0622 (18) | −0.026 (2) | 0.026 (2) | 0.0171 (18) |
| C33 | 0.099 (2) | 0.0587 (18) | 0.096 (2) | −0.0257 (17) | 0.0102 (19) | 0.0013 (17) |
| C34 | 0.099 (2) | 0.077 (2) | 0.085 (2) | −0.020 (2) | −0.0014 (19) | 0.0404 (19) |
| C21 | 0.129 (3) | 0.111 (3) | 0.081 (2) | 0.075 (2) | −0.046 (2) | −0.057 (2) |
| C36 | 0.0541 (16) | 0.097 (3) | 0.121 (3) | −0.0101 (18) | 0.0260 (18) | 0.023 (2) |
| C22 | 0.088 (2) | 0.0461 (18) | 0.180 (4) | 0.0015 (16) | −0.009 (3) | −0.010 (2) |
| Fe1—C21 | 2.017 (3) | C31—H31 | 0.9800 |
| Fe1—C22 | 2.027 (3) | C16—C17 | 1.419 (4) |
| Fe1—C25 | 2.028 (3) | C16—C20 | 1.427 (4) |
| Fe1—C18 | 2.032 (3) | C27—C28 | 1.432 (3) |
| Fe1—C23 | 2.038 (3) | C13—C12 | 1.368 (4) |
| Fe1—C20 | 2.044 (3) | C13—H13 | 0.9300 |
| Fe1—C19 | 2.045 (3) | C12—C11 | 1.371 (4) |
| Fe1—C24 | 2.048 (3) | C12—H12 | 0.9300 |
| Fe1—C17 | 2.048 (3) | C28—C29 | 1.403 (4) |
| Fe1—C16 | 2.053 (3) | C28—H28 | 0.9800 |
| Fe2—C32 | 2.025 (3) | C11—H11 | 0.9300 |
| Fe2—C36 | 2.031 (3) | C4—C5 | 1.376 (4) |
| Fe2—C34 | 2.037 (3) | C4—H4 | 0.9300 |
| Fe2—C33 | 2.040 (3) | C6—C7 | 1.363 (5) |
| Fe2—C35 | 2.040 (3) | C6—C5 | 1.370 (5) |
| Fe2—C31 | 2.041 (2) | C6—H6 | 0.9300 |
| Fe2—C27 | 2.041 (2) | C20—C19 | 1.414 (4) |
| Fe2—C28 | 2.043 (3) | C20—H20 | 0.9800 |
| Fe2—C29 | 2.042 (3) | C17—C18 | 1.425 (4) |
| Fe2—C30 | 2.045 (3) | C17—H17 | 0.9800 |
| N2—C2 | 1.466 (3) | C29—C30 | 1.403 (4) |
| N2—C26 | 1.472 (3) | C29—H29 | 0.9800 |
| N2—H102 | 0.8600 | C32—C36 | 1.394 (5) |
| N1—C15 | 1.455 (3) | C32—C33 | 1.403 (5) |
| N1—C1 | 1.469 (3) | C32—H32 | 0.9800 |
| N1—H101 | 0.8599 | C5—H5 | 0.9300 |
| C3—C8 | 1.386 (3) | C30—H30 | 0.9800 |
| C3—C4 | 1.389 (3) | C24—C23 | 1.331 (5) |
| C3—C1 | 1.513 (3) | C24—C25 | 1.355 (5) |
| C2—C9 | 1.524 (3) | C24—H24 | 0.9800 |
| C2—C1 | 1.542 (3) | C18—C19 | 1.418 (4) |
| C2—H2 | 0.9800 | C18—H18 | 0.9800 |
| C1—H1 | 0.9800 | C19—H19 | 0.9800 |
| C9—C10 | 1.384 (3) | C7—H7 | 0.9300 |
| C9—C14 | 1.393 (3) | C23—C22 | 1.366 (5) |
| C8—C7 | 1.389 (4) | C23—H23 | 0.9800 |
| C8—H8 | 0.9300 | C25—C21 | 1.422 (6) |
| C14—C13 | 1.379 (3) | C25—H25 | 0.9800 |
| C14—H14 | 0.9300 | C35—C34 | 1.388 (5) |
| C15—C16 | 1.500 (3) | C35—C36 | 1.415 (5) |
| C15—H15A | 0.9700 | C35—H35 | 0.9800 |
| C15—H15B | 0.9700 | C33—C34 | 1.411 (5) |
| C26—C27 | 1.501 (3) | C33—H33 | 0.9800 |
| C26—H26A | 0.9700 | C34—H34 | 0.9800 |
| C26—H26B | 0.9700 | C21—C22 | 1.439 (6) |
| C10—C11 | 1.393 (4) | C21—H21 | 0.9800 |
| C10—H10 | 0.9300 | C36—H36 | 0.9800 |
| C31—C27 | 1.419 (3) | C22—H22 | 0.9800 |
| C31—C30 | 1.426 (4) | ||
| C21—Fe1—C22 | 41.69 (17) | C27—C31—H31 | 125.8 |
| C21—Fe1—C25 | 41.16 (17) | C30—C31—H31 | 125.8 |
| C22—Fe1—C25 | 68.18 (17) | Fe2—C31—H31 | 125.8 |
| C21—Fe1—C18 | 157.5 (2) | C17—C16—C20 | 107.6 (2) |
| C22—Fe1—C18 | 119.99 (18) | C17—C16—C15 | 127.2 (2) |
| C25—Fe1—C18 | 158.24 (17) | C20—C16—C15 | 125.1 (2) |
| C21—Fe1—C23 | 67.22 (15) | C17—C16—Fe1 | 69.57 (15) |
| C22—Fe1—C23 | 39.29 (15) | C20—C16—Fe1 | 69.28 (14) |
| C25—Fe1—C23 | 65.34 (14) | C15—C16—Fe1 | 128.65 (18) |
| C18—Fe1—C23 | 107.09 (14) | C31—C27—C28 | 106.6 (2) |
| C21—Fe1—C20 | 126.43 (17) | C31—C27—C26 | 128.9 (2) |
| C22—Fe1—C20 | 165.16 (17) | C28—C27—C26 | 124.6 (2) |
| C25—Fe1—C20 | 108.78 (14) | C31—C27—Fe2 | 69.63 (13) |
| C18—Fe1—C20 | 68.46 (13) | C28—C27—Fe2 | 69.51 (13) |
| C23—Fe1—C20 | 154.00 (14) | C26—C27—Fe2 | 126.48 (16) |
| C21—Fe1—C19 | 161.5 (2) | C12—C13—C14 | 120.8 (3) |
| C22—Fe1—C19 | 153.65 (19) | C12—C13—H13 | 119.6 |
| C25—Fe1—C19 | 123.20 (17) | C14—C13—H13 | 119.6 |
| C18—Fe1—C19 | 40.69 (13) | C13—C12—C11 | 119.7 (2) |
| C23—Fe1—C19 | 119.45 (14) | C13—C12—H12 | 120.2 |
| C20—Fe1—C19 | 40.45 (11) | C11—C12—H12 | 120.2 |
| C21—Fe1—C24 | 67.14 (15) | C29—C28—C27 | 108.7 (3) |
| C22—Fe1—C24 | 66.07 (16) | C29—C28—Fe2 | 69.90 (16) |
| C25—Fe1—C24 | 38.83 (14) | C27—C28—Fe2 | 69.43 (14) |
| C18—Fe1—C24 | 122.74 (13) | C29—C28—H28 | 125.7 |
| C23—Fe1—C24 | 38.02 (14) | C27—C28—H28 | 125.7 |
| C20—Fe1—C24 | 121.35 (14) | Fe2—C28—H28 | 125.7 |
| C19—Fe1—C24 | 106.67 (14) | C12—C11—C10 | 120.0 (3) |
| C21—Fe1—C17 | 123.49 (16) | C12—C11—H11 | 120.0 |
| C22—Fe1—C17 | 109.24 (15) | C10—C11—H11 | 120.0 |
| C25—Fe1—C17 | 160.00 (15) | C5—C4—C3 | 121.7 (3) |
| C18—Fe1—C17 | 40.88 (11) | C5—C4—H4 | 119.1 |
| C23—Fe1—C17 | 126.06 (14) | C3—C4—H4 | 119.1 |
| C20—Fe1—C17 | 68.31 (12) | C7—C6—C5 | 120.0 (3) |
| C19—Fe1—C17 | 68.33 (13) | C7—C6—H6 | 120.0 |
| C24—Fe1—C17 | 159.91 (13) | C5—C6—H6 | 120.0 |
| C21—Fe1—C16 | 110.33 (12) | C19—C20—C16 | 108.2 (3) |
| C22—Fe1—C16 | 127.96 (15) | C19—C20—Fe1 | 69.82 (17) |
| C25—Fe1—C16 | 124.39 (13) | C16—C20—Fe1 | 69.94 (15) |
| C18—Fe1—C16 | 68.58 (11) | C19—C20—H20 | 125.9 |
| C23—Fe1—C16 | 163.57 (14) | C16—C20—H20 | 125.9 |
| C20—Fe1—C16 | 40.77 (10) | Fe1—C20—H20 | 125.9 |
| C19—Fe1—C16 | 68.32 (11) | C16—C17—C18 | 108.0 (3) |
| C24—Fe1—C16 | 157.64 (13) | C16—C17—Fe1 | 69.94 (14) |
| C17—Fe1—C16 | 40.49 (11) | C18—C17—Fe1 | 68.95 (15) |
| C32—Fe2—C36 | 40.19 (15) | C16—C17—H17 | 126.0 |
| C32—Fe2—C34 | 67.56 (15) | C18—C17—H17 | 126.0 |
| C36—Fe2—C34 | 67.48 (16) | Fe1—C17—H17 | 126.0 |
| C32—Fe2—C33 | 40.38 (15) | C30—C29—C28 | 108.5 (2) |
| C36—Fe2—C33 | 67.92 (17) | C30—C29—Fe2 | 70.03 (17) |
| C34—Fe2—C33 | 40.50 (14) | C28—C29—Fe2 | 69.93 (15) |
| C32—Fe2—C35 | 67.93 (14) | C30—C29—H29 | 125.7 |
| C36—Fe2—C35 | 40.68 (14) | C28—C29—H29 | 125.7 |
| C34—Fe2—C35 | 39.82 (14) | Fe2—C29—H29 | 125.7 |
| C33—Fe2—C35 | 67.99 (15) | C36—C32—C33 | 108.8 (3) |
| C32—Fe2—C31 | 115.35 (13) | C36—C32—Fe2 | 70.16 (19) |
| C36—Fe2—C31 | 145.84 (14) | C33—C32—Fe2 | 70.39 (19) |
| C34—Fe2—C31 | 134.21 (15) | C36—C32—H32 | 125.6 |
| C33—Fe2—C31 | 109.89 (13) | C33—C32—H32 | 125.6 |
| C35—Fe2—C31 | 172.72 (14) | Fe2—C32—H32 | 125.6 |
| C32—Fe2—C27 | 107.67 (12) | C6—C5—C4 | 119.6 (3) |
| C36—Fe2—C27 | 113.64 (14) | C6—C5—H5 | 120.2 |
| C34—Fe2—C27 | 171.77 (14) | C4—C5—H5 | 120.2 |
| C33—Fe2—C27 | 131.60 (12) | C29—C30—C31 | 107.8 (2) |
| C35—Fe2—C27 | 145.91 (14) | C29—C30—Fe2 | 69.81 (16) |
| C31—Fe2—C27 | 40.68 (10) | C31—C30—Fe2 | 69.40 (13) |
| C32—Fe2—C28 | 131.46 (15) | C29—C30—H30 | 126.1 |
| C36—Fe2—C28 | 108.35 (15) | C31—C30—H30 | 126.1 |
| C34—Fe2—C28 | 147.09 (14) | Fe2—C30—H30 | 126.1 |
| C33—Fe2—C28 | 170.75 (14) | C23—C24—C25 | 109.6 (4) |
| C35—Fe2—C28 | 115.18 (14) | C23—C24—Fe1 | 70.6 (2) |
| C31—Fe2—C28 | 68.07 (11) | C25—C24—Fe1 | 69.8 (2) |
| C27—Fe2—C28 | 41.06 (9) | C23—C24—H24 | 125.2 |
| C32—Fe2—C29 | 170.43 (17) | C25—C24—H24 | 125.2 |
| C36—Fe2—C29 | 132.14 (17) | Fe1—C24—H24 | 125.2 |
| C34—Fe2—C29 | 117.11 (13) | C19—C18—C17 | 108.0 (3) |
| C33—Fe2—C29 | 148.42 (15) | C19—C18—Fe1 | 70.17 (16) |
| C35—Fe2—C29 | 109.77 (14) | C17—C18—Fe1 | 70.18 (14) |
| C31—Fe2—C29 | 68.11 (12) | C19—C18—H18 | 126.0 |
| C27—Fe2—C29 | 68.68 (10) | C17—C18—H18 | 126.0 |
| C28—Fe2—C29 | 40.17 (11) | Fe1—C18—H18 | 126.0 |
| C32—Fe2—C30 | 147.94 (16) | C20—C19—C18 | 108.2 (3) |
| C36—Fe2—C30 | 171.54 (16) | C20—C19—Fe1 | 69.73 (15) |
| C34—Fe2—C30 | 111.41 (14) | C18—C19—Fe1 | 69.14 (16) |
| C33—Fe2—C30 | 117.11 (15) | C20—C19—H19 | 125.9 |
| C35—Fe2—C30 | 133.17 (14) | C18—C19—H19 | 125.9 |
| C31—Fe2—C30 | 40.85 (11) | Fe1—C19—H19 | 125.9 |
| C27—Fe2—C30 | 68.75 (10) | C6—C7—C8 | 120.8 (3) |
| C28—Fe2—C30 | 67.72 (12) | C6—C7—H7 | 119.6 |
| C29—Fe2—C30 | 40.16 (13) | C8—C7—H7 | 119.6 |
| C2—N2—C26 | 114.44 (19) | C24—C23—C22 | 110.9 (4) |
| C2—N2—H102 | 108.1 | C24—C23—Fe1 | 71.4 (2) |
| C26—N2—H102 | 105.5 | C22—C23—Fe1 | 69.9 (2) |
| C15—N1—C1 | 114.88 (19) | C24—C23—H23 | 124.6 |
| C15—N1—H101 | 109.1 | C22—C23—H23 | 124.6 |
| C1—N1—H101 | 111.0 | Fe1—C23—H23 | 124.6 |
| C8—C3—C4 | 117.7 (2) | C24—C25—C21 | 108.1 (4) |
| C8—C3—C1 | 120.3 (2) | C24—C25—Fe1 | 71.39 (19) |
| C4—C3—C1 | 121.6 (2) | C21—C25—Fe1 | 69.0 (2) |
| N2—C2—C9 | 111.58 (17) | C24—C25—H25 | 126.0 |
| N2—C2—C1 | 108.22 (19) | C21—C25—H25 | 126.0 |
| C9—C2—C1 | 110.45 (17) | Fe1—C25—H25 | 126.0 |
| N2—C2—H2 | 108.8 | C34—C35—C36 | 107.4 (3) |
| C9—C2—H2 | 108.8 | C34—C35—Fe2 | 69.98 (18) |
| C1—C2—H2 | 108.8 | C36—C35—Fe2 | 69.32 (17) |
| N1—C1—C3 | 116.08 (19) | C34—C35—H35 | 126.3 |
| N1—C1—C2 | 107.45 (17) | C36—C35—H35 | 126.3 |
| C3—C1—C2 | 111.57 (19) | Fe2—C35—H35 | 126.3 |
| N1—C1—H1 | 107.1 | C32—C33—C34 | 106.8 (3) |
| C3—C1—H1 | 107.1 | C32—C33—Fe2 | 69.23 (19) |
| C2—C1—H1 | 107.1 | C34—C33—Fe2 | 69.65 (19) |
| C10—C9—C14 | 118.2 (2) | C32—C33—H33 | 126.6 |
| C10—C9—C2 | 121.1 (2) | C34—C33—H33 | 126.6 |
| C14—C9—C2 | 120.5 (2) | Fe2—C33—H33 | 126.6 |
| C3—C8—C7 | 120.2 (3) | C35—C34—C33 | 109.1 (3) |
| C3—C8—H8 | 119.9 | C35—C34—Fe2 | 70.20 (19) |
| C7—C8—H8 | 119.9 | C33—C34—Fe2 | 69.84 (17) |
| C13—C14—C9 | 120.5 (2) | C35—C34—H34 | 125.4 |
| C13—C14—H14 | 119.8 | C33—C34—H34 | 125.4 |
| C9—C14—H14 | 119.8 | Fe2—C34—H34 | 125.4 |
| N1—C15—C16 | 111.5 (2) | C25—C21—C22 | 105.2 (3) |
| N1—C15—H15A | 109.3 | C25—C21—Fe1 | 69.81 (18) |
| C16—C15—H15A | 109.3 | C22—C21—Fe1 | 69.51 (19) |
| N1—C15—H15B | 109.3 | C25—C21—H21 | 127.4 |
| C16—C15—H15B | 109.3 | C22—C21—H21 | 127.4 |
| H15A—C15—H15B | 108.0 | Fe1—C21—H21 | 127.4 |
| N2—C26—C27 | 113.71 (19) | C32—C36—C35 | 107.9 (4) |
| N2—C26—H26A | 108.8 | C32—C36—Fe2 | 69.65 (18) |
| C27—C26—H26A | 108.8 | C35—C36—Fe2 | 70.00 (18) |
| N2—C26—H26B | 108.8 | C32—C36—H36 | 126.1 |
| C27—C26—H26B | 108.8 | C35—C36—H36 | 126.1 |
| H26A—C26—H26B | 107.7 | Fe2—C36—H36 | 126.1 |
| C9—C10—C11 | 120.8 (2) | C23—C22—C21 | 106.3 (3) |
| C9—C10—H10 | 119.6 | C23—C22—Fe1 | 70.8 (2) |
| C11—C10—H10 | 119.6 | C21—C22—Fe1 | 68.8 (2) |
| C27—C31—C30 | 108.4 (2) | C23—C22—H22 | 126.9 |
| C27—C31—Fe2 | 69.69 (12) | C21—C22—H22 | 126.9 |
| C30—C31—Fe2 | 69.75 (14) | Fe1—C22—H22 | 126.9 |
| C26—N2—C2—C9 | −85.0 (2) | C27—Fe2—C30—C31 | 37.41 (16) |
| C26—N2—C2—C1 | 153.26 (18) | C28—Fe2—C30—C31 | 81.77 (17) |
| C15—N1—C1—C3 | −58.8 (3) | C29—Fe2—C30—C31 | 119.1 (3) |
| C15—N1—C1—C2 | 175.5 (2) | C21—Fe1—C24—C23 | 81.8 (3) |
| C8—C3—C1—N1 | 134.4 (2) | C22—Fe1—C24—C23 | 36.2 (3) |
| C4—C3—C1—N1 | −51.6 (3) | C25—Fe1—C24—C23 | 120.6 (4) |
| C8—C3—C1—C2 | −102.1 (3) | C18—Fe1—C24—C23 | −75.2 (3) |
| C4—C3—C1—C2 | 71.9 (3) | C20—Fe1—C24—C23 | −158.4 (2) |
| N2—C2—C1—N1 | −64.2 (2) | C19—Fe1—C24—C23 | −116.8 (3) |
| C9—C2—C1—N1 | 173.44 (18) | C17—Fe1—C24—C23 | −44.4 (5) |
| N2—C2—C1—C3 | 167.55 (17) | C16—Fe1—C24—C23 | 169.8 (3) |
| C9—C2—C1—C3 | 45.1 (2) | C21—Fe1—C24—C25 | −38.8 (3) |
| N2—C2—C9—C10 | 144.6 (2) | C22—Fe1—C24—C25 | −84.4 (3) |
| C1—C2—C9—C10 | −95.0 (3) | C18—Fe1—C24—C25 | 164.2 (3) |
| N2—C2—C9—C14 | −40.9 (3) | C23—Fe1—C24—C25 | −120.6 (4) |
| C1—C2—C9—C14 | 79.5 (2) | C20—Fe1—C24—C25 | 81.0 (3) |
| C4—C3—C8—C7 | −1.7 (4) | C19—Fe1—C24—C25 | 122.6 (3) |
| C1—C3—C8—C7 | 172.5 (3) | C17—Fe1—C24—C25 | −165.0 (4) |
| C10—C9—C14—C13 | 1.6 (4) | C16—Fe1—C24—C25 | 49.3 (5) |
| C2—C9—C14—C13 | −173.0 (2) | C16—C17—C18—C19 | −1.1 (3) |
| C1—N1—C15—C16 | −179.8 (2) | Fe1—C17—C18—C19 | −60.3 (2) |
| C2—N2—C26—C27 | −76.0 (2) | C16—C17—C18—Fe1 | 59.21 (19) |
| C14—C9—C10—C11 | −1.8 (4) | C21—Fe1—C18—C19 | 172.9 (3) |
| C2—C9—C10—C11 | 172.8 (2) | C22—Fe1—C18—C19 | −156.3 (2) |
| C32—Fe2—C31—C27 | −87.9 (2) | C25—Fe1—C18—C19 | −49.6 (5) |
| C36—Fe2—C31—C27 | −51.8 (3) | C23—Fe1—C18—C19 | −115.6 (2) |
| C34—Fe2—C31—C27 | −170.57 (18) | C20—Fe1—C18—C19 | 37.27 (18) |
| C33—Fe2—C31—C27 | −131.48 (17) | C24—Fe1—C18—C19 | −77.0 (2) |
| C28—Fe2—C31—C27 | 38.86 (14) | C17—Fe1—C18—C19 | 118.6 (3) |
| C29—Fe2—C31—C27 | 82.32 (17) | C16—Fe1—C18—C19 | 81.24 (19) |
| C30—Fe2—C31—C27 | 119.7 (2) | C21—Fe1—C18—C17 | 54.3 (4) |
| C32—Fe2—C31—C30 | 152.4 (2) | C22—Fe1—C18—C17 | 85.1 (2) |
| C36—Fe2—C31—C30 | −171.5 (3) | C25—Fe1—C18—C17 | −168.2 (4) |
| C34—Fe2—C31—C30 | 69.7 (3) | C23—Fe1—C18—C17 | 125.9 (2) |
| C33—Fe2—C31—C30 | 108.8 (2) | C20—Fe1—C18—C17 | −81.3 (2) |
| C27—Fe2—C31—C30 | −119.7 (2) | C19—Fe1—C18—C17 | −118.6 (3) |
| C28—Fe2—C31—C30 | −80.83 (19) | C24—Fe1—C18—C17 | 164.4 (2) |
| C29—Fe2—C31—C30 | −37.38 (19) | C16—Fe1—C18—C17 | −37.34 (18) |
| N1—C15—C16—C17 | 28.7 (4) | C16—C20—C19—C18 | −1.0 (3) |
| N1—C15—C16—C20 | −154.4 (2) | Fe1—C20—C19—C18 | 58.6 (2) |
| N1—C15—C16—Fe1 | −64.0 (3) | C16—C20—C19—Fe1 | −59.64 (18) |
| C21—Fe1—C16—C17 | −118.2 (2) | C17—C18—C19—C20 | 1.3 (3) |
| C22—Fe1—C16—C17 | −74.3 (3) | Fe1—C18—C19—C20 | −59.0 (2) |
| C25—Fe1—C16—C17 | −162.2 (2) | C17—C18—C19—Fe1 | 60.3 (2) |
| C18—Fe1—C16—C17 | 37.69 (18) | C21—Fe1—C19—C20 | −51.6 (5) |
| C23—Fe1—C16—C17 | −39.9 (5) | C22—Fe1—C19—C20 | 171.4 (3) |
| C20—Fe1—C16—C17 | 119.1 (2) | C25—Fe1—C19—C20 | −80.0 (2) |
| C19—Fe1—C16—C17 | 81.59 (18) | C18—Fe1—C19—C20 | 119.8 (3) |
| C24—Fe1—C16—C17 | 162.7 (3) | C23—Fe1—C19—C20 | −158.24 (19) |
| C21—Fe1—C16—C20 | 122.7 (2) | C24—Fe1—C19—C20 | −119.1 (2) |
| C22—Fe1—C16—C20 | 166.6 (2) | C17—Fe1—C19—C20 | 81.55 (19) |
| C25—Fe1—C16—C20 | 78.7 (2) | C16—Fe1—C19—C20 | 37.83 (17) |
| C18—Fe1—C16—C20 | −81.43 (18) | C21—Fe1—C19—C18 | −171.4 (4) |
| C23—Fe1—C16—C20 | −159.0 (4) | C22—Fe1—C19—C18 | 51.6 (4) |
| C19—Fe1—C16—C20 | −37.54 (18) | C25—Fe1—C19—C18 | 160.29 (19) |
| C24—Fe1—C16—C20 | 43.5 (4) | C23—Fe1—C19—C18 | 82.0 (2) |
| C17—Fe1—C16—C20 | −119.1 (2) | C20—Fe1—C19—C18 | −119.8 (3) |
| C21—Fe1—C16—C15 | 3.7 (3) | C24—Fe1—C19—C18 | 121.18 (19) |
| C22—Fe1—C16—C15 | 47.5 (3) | C17—Fe1—C19—C18 | −38.20 (17) |
| C25—Fe1—C16—C15 | −40.3 (3) | C16—Fe1—C19—C18 | −81.92 (19) |
| C18—Fe1—C16—C15 | 159.6 (3) | C5—C6—C7—C8 | 0.6 (5) |
| C23—Fe1—C16—C15 | 81.9 (5) | C3—C8—C7—C6 | 0.8 (5) |
| C20—Fe1—C16—C15 | −119.0 (3) | C25—C24—C23—C22 | 0.1 (4) |
| C19—Fe1—C16—C15 | −156.5 (3) | Fe1—C24—C23—C22 | −58.9 (3) |
| C24—Fe1—C16—C15 | −75.5 (4) | C25—C24—C23—Fe1 | 59.0 (3) |
| C17—Fe1—C16—C15 | 121.9 (3) | C21—Fe1—C23—C24 | −81.5 (3) |
| C30—C31—C27—C28 | −0.8 (3) | C22—Fe1—C23—C24 | −121.6 (4) |
| Fe2—C31—C27—C28 | −60.00 (16) | C25—Fe1—C23—C24 | −36.4 (2) |
| C30—C31—C27—C26 | −179.8 (2) | C18—Fe1—C23—C24 | 121.7 (2) |
| Fe2—C31—C27—C26 | 121.0 (2) | C20—Fe1—C23—C24 | 45.9 (4) |
| C30—C31—C27—Fe2 | 59.19 (17) | C19—Fe1—C23—C24 | 79.2 (3) |
| N2—C26—C27—C31 | 103.7 (3) | C17—Fe1—C23—C24 | 162.7 (2) |
| N2—C26—C27—C28 | −75.1 (3) | C16—Fe1—C23—C24 | −166.3 (4) |
| N2—C26—C27—Fe2 | −164.03 (15) | C21—Fe1—C23—C22 | 40.0 (3) |
| C32—Fe2—C27—C31 | 108.58 (19) | C25—Fe1—C23—C22 | 85.1 (3) |
| C36—Fe2—C27—C31 | 151.2 (2) | C18—Fe1—C23—C22 | −116.7 (3) |
| C33—Fe2—C27—C31 | 70.4 (2) | C20—Fe1—C23—C22 | 167.5 (3) |
| C35—Fe2—C27—C31 | −174.9 (2) | C19—Fe1—C23—C22 | −159.2 (3) |
| C28—Fe2—C27—C31 | −117.6 (2) | C24—Fe1—C23—C22 | 121.6 (4) |
| C29—Fe2—C27—C31 | −80.80 (18) | C17—Fe1—C23—C22 | −75.7 (3) |
| C30—Fe2—C27—C31 | −37.56 (17) | C16—Fe1—C23—C22 | −44.7 (6) |
| C32—Fe2—C27—C28 | −133.82 (18) | C23—C24—C25—C21 | 0.0 (4) |
| C36—Fe2—C27—C28 | −91.2 (2) | Fe1—C24—C25—C21 | 59.5 (2) |
| C33—Fe2—C27—C28 | −172.0 (2) | C23—C24—C25—Fe1 | −59.5 (3) |
| C35—Fe2—C27—C28 | −57.3 (3) | C21—Fe1—C25—C24 | 118.7 (3) |
| C31—Fe2—C27—C28 | 117.6 (2) | C22—Fe1—C25—C24 | 78.5 (3) |
| C29—Fe2—C27—C28 | 36.80 (17) | C18—Fe1—C25—C24 | −38.2 (5) |
| C30—Fe2—C27—C28 | 80.04 (18) | C23—Fe1—C25—C24 | 35.7 (2) |
| C32—Fe2—C27—C26 | −15.3 (2) | C20—Fe1—C25—C24 | −117.0 (2) |
| C36—Fe2—C27—C26 | 27.3 (3) | C19—Fe1—C25—C24 | −74.6 (3) |
| C33—Fe2—C27—C26 | −53.5 (3) | C17—Fe1—C25—C24 | 164.9 (4) |
| C35—Fe2—C27—C26 | 61.2 (3) | C16—Fe1—C25—C24 | −159.6 (2) |
| C31—Fe2—C27—C26 | −123.9 (3) | C22—Fe1—C25—C21 | −40.2 (2) |
| C28—Fe2—C27—C26 | 118.5 (3) | C18—Fe1—C25—C21 | −156.9 (4) |
| C29—Fe2—C27—C26 | 155.3 (2) | C23—Fe1—C25—C21 | −83.0 (2) |
| C30—Fe2—C27—C26 | −161.5 (2) | C20—Fe1—C25—C21 | 124.3 (2) |
| C9—C14—C13—C12 | −0.5 (4) | C19—Fe1—C25—C21 | 166.8 (2) |
| C14—C13—C12—C11 | −0.4 (4) | C24—Fe1—C25—C21 | −118.7 (3) |
| C31—C27—C28—C29 | 1.0 (3) | C17—Fe1—C25—C21 | 46.3 (5) |
| C26—C27—C28—C29 | −179.9 (2) | C16—Fe1—C25—C21 | 81.8 (3) |
| Fe2—C27—C28—C29 | −59.04 (18) | C32—Fe2—C35—C34 | −81.0 (3) |
| C31—C27—C28—Fe2 | 60.08 (16) | C36—Fe2—C35—C34 | −118.5 (4) |
| C26—C27—C28—Fe2 | −120.9 (2) | C33—Fe2—C35—C34 | −37.3 (2) |
| C32—Fe2—C28—C29 | −173.3 (2) | C27—Fe2—C35—C34 | −170.1 (2) |
| C36—Fe2—C28—C29 | −134.7 (2) | C28—Fe2—C35—C34 | 152.2 (2) |
| C34—Fe2—C28—C29 | −58.0 (3) | C29—Fe2—C35—C34 | 109.0 (2) |
| C35—Fe2—C28—C29 | −91.3 (2) | C30—Fe2—C35—C34 | 69.9 (3) |
| C31—Fe2—C28—C29 | 81.60 (18) | C32—Fe2—C35—C36 | 37.6 (2) |
| C27—Fe2—C28—C29 | 120.1 (2) | C34—Fe2—C35—C36 | 118.5 (4) |
| C30—Fe2—C28—C29 | 37.35 (17) | C33—Fe2—C35—C36 | 81.3 (3) |
| C32—Fe2—C28—C27 | 66.6 (2) | C27—Fe2—C35—C36 | −51.6 (3) |
| C36—Fe2—C28—C27 | 105.22 (19) | C28—Fe2—C35—C36 | −89.2 (3) |
| C34—Fe2—C28—C27 | −178.1 (2) | C29—Fe2—C35—C36 | −132.5 (3) |
| C35—Fe2—C28—C27 | 148.59 (17) | C30—Fe2—C35—C36 | −171.6 (2) |
| C31—Fe2—C28—C27 | −38.51 (14) | C36—C32—C33—C34 | 0.0 (4) |
| C29—Fe2—C28—C27 | −120.1 (2) | Fe2—C32—C33—C34 | −59.8 (2) |
| C30—Fe2—C28—C27 | −82.77 (16) | C36—C32—C33—Fe2 | 59.9 (2) |
| C13—C12—C11—C10 | 0.3 (5) | C36—Fe2—C33—C32 | −37.3 (2) |
| C9—C10—C11—C12 | 0.8 (4) | C34—Fe2—C33—C32 | −118.0 (3) |
| C8—C3—C4—C5 | 1.4 (4) | C35—Fe2—C33—C32 | −81.4 (2) |
| C1—C3—C4—C5 | −172.8 (3) | C31—Fe2—C33—C32 | 106.1 (2) |
| C17—C16—C20—C19 | 0.4 (3) | C27—Fe2—C33—C32 | 65.3 (3) |
| C15—C16—C20—C19 | −177.0 (2) | C29—Fe2—C33—C32 | −173.6 (2) |
| Fe1—C16—C20—C19 | 59.57 (19) | C30—Fe2—C33—C32 | 150.2 (2) |
| C17—C16—C20—Fe1 | −59.21 (19) | C32—Fe2—C33—C34 | 118.0 (3) |
| C15—C16—C20—Fe1 | 123.4 (2) | C36—Fe2—C33—C34 | 80.7 (2) |
| C21—Fe1—C20—C19 | 162.0 (2) | C35—Fe2—C33—C34 | 36.6 (2) |
| C22—Fe1—C20—C19 | −164.9 (5) | C31—Fe2—C33—C34 | −135.9 (2) |
| C25—Fe1—C20—C19 | 119.5 (2) | C27—Fe2—C33—C34 | −176.7 (2) |
| C18—Fe1—C20—C19 | −37.48 (18) | C29—Fe2—C33—C34 | −55.6 (4) |
| C23—Fe1—C20—C19 | 47.4 (4) | C30—Fe2—C33—C34 | −91.8 (2) |
| C24—Fe1—C20—C19 | 78.6 (2) | C36—C35—C34—C33 | −0.3 (4) |
| C17—Fe1—C20—C19 | −81.61 (19) | Fe2—C35—C34—C33 | 59.2 (2) |
| C16—Fe1—C20—C19 | −119.2 (3) | C36—C35—C34—Fe2 | −59.5 (2) |
| C21—Fe1—C20—C16 | −78.8 (2) | C32—C33—C34—C35 | 0.2 (4) |
| C22—Fe1—C20—C16 | −45.7 (6) | Fe2—C33—C34—C35 | −59.4 (2) |
| C25—Fe1—C20—C16 | −121.3 (2) | C32—C33—C34—Fe2 | 59.6 (2) |
| C18—Fe1—C20—C16 | 81.75 (17) | C32—Fe2—C34—C35 | 82.0 (3) |
| C23—Fe1—C20—C16 | 166.7 (3) | C36—Fe2—C34—C35 | 38.3 (2) |
| C19—Fe1—C20—C16 | 119.2 (3) | C33—Fe2—C34—C35 | 120.2 (3) |
| C24—Fe1—C20—C16 | −162.13 (17) | C31—Fe2—C34—C35 | −173.9 (2) |
| C17—Fe1—C20—C16 | 37.62 (15) | C28—Fe2—C34—C35 | −50.9 (4) |
| C20—C16—C17—C18 | 0.4 (3) | C29—Fe2—C34—C35 | −88.8 (3) |
| C15—C16—C17—C18 | 177.8 (3) | C30—Fe2—C34—C35 | −132.6 (2) |
| Fe1—C16—C17—C18 | −58.6 (2) | C32—Fe2—C34—C33 | −38.2 (2) |
| C20—C16—C17—Fe1 | 59.03 (18) | C36—Fe2—C34—C33 | −81.9 (3) |
| C15—C16—C17—Fe1 | −123.6 (3) | C35—Fe2—C34—C33 | −120.2 (3) |
| C21—Fe1—C17—C16 | 82.3 (2) | C31—Fe2—C34—C33 | 65.9 (3) |
| C22—Fe1—C17—C16 | 126.5 (2) | C28—Fe2—C34—C33 | −171.1 (2) |
| C25—Fe1—C17—C16 | 47.6 (5) | C29—Fe2—C34—C33 | 151.0 (2) |
| C18—Fe1—C17—C16 | −119.6 (3) | C30—Fe2—C34—C33 | 107.1 (2) |
| C23—Fe1—C17—C16 | 167.03 (19) | C24—C25—C21—C22 | −0.1 (4) |
| C20—Fe1—C17—C16 | −37.88 (15) | Fe1—C25—C21—C22 | 60.9 (2) |
| C19—Fe1—C17—C16 | −81.56 (18) | C24—C25—C21—Fe1 | −61.0 (2) |
| C24—Fe1—C17—C16 | −160.7 (4) | C22—Fe1—C21—C25 | 115.8 (3) |
| C21—Fe1—C17—C18 | −158.1 (3) | C18—Fe1—C21—C25 | 157.7 (3) |
| C22—Fe1—C17—C18 | −113.9 (3) | C23—Fe1—C21—C25 | 78.0 (2) |
| C25—Fe1—C17—C18 | 167.1 (4) | C20—Fe1—C21—C25 | −76.3 (2) |
| C23—Fe1—C17—C18 | −73.4 (3) | C19—Fe1—C21—C25 | −37.1 (5) |
| C20—Fe1—C17—C18 | 81.7 (2) | C24—Fe1—C21—C25 | 36.7 (2) |
| C19—Fe1—C17—C18 | 38.0 (2) | C17—Fe1—C21—C25 | −162.8 (2) |
| C24—Fe1—C17—C18 | −41.2 (5) | C16—Fe1—C21—C25 | −119.4 (2) |
| C16—Fe1—C17—C18 | 119.6 (3) | C25—Fe1—C21—C22 | −115.8 (3) |
| C27—C28—C29—C30 | −0.9 (3) | C18—Fe1—C21—C22 | 41.9 (4) |
| Fe2—C28—C29—C30 | −59.6 (2) | C23—Fe1—C21—C22 | −37.8 (2) |
| C27—C28—C29—Fe2 | 58.75 (17) | C20—Fe1—C21—C22 | 167.9 (2) |
| C36—Fe2—C29—C30 | −174.9 (2) | C19—Fe1—C21—C22 | −152.9 (4) |
| C34—Fe2—C29—C30 | −91.7 (2) | C24—Fe1—C21—C22 | −79.1 (2) |
| C33—Fe2—C29—C30 | −54.7 (3) | C17—Fe1—C21—C22 | 81.4 (2) |
| C35—Fe2—C29—C30 | −134.5 (2) | C16—Fe1—C21—C22 | 124.8 (2) |
| C31—Fe2—C29—C30 | 38.01 (17) | C33—C32—C36—C35 | −0.2 (4) |
| C27—Fe2—C29—C30 | 81.91 (17) | Fe2—C32—C36—C35 | 59.8 (2) |
| C28—Fe2—C29—C30 | 119.5 (2) | C33—C32—C36—Fe2 | −60.0 (2) |
| C36—Fe2—C29—C28 | 65.6 (2) | C34—C35—C36—C32 | 0.3 (4) |
| C34—Fe2—C29—C28 | 148.84 (19) | Fe2—C35—C36—C32 | −59.6 (2) |
| C33—Fe2—C29—C28 | −174.2 (2) | C34—C35—C36—Fe2 | 59.9 (2) |
| C35—Fe2—C29—C28 | 106.0 (2) | C34—Fe2—C36—C32 | 81.4 (3) |
| C31—Fe2—C29—C28 | −81.48 (17) | C33—Fe2—C36—C32 | 37.5 (2) |
| C27—Fe2—C29—C28 | −37.58 (15) | C35—Fe2—C36—C32 | 118.9 (4) |
| C30—Fe2—C29—C28 | −119.5 (2) | C31—Fe2—C36—C32 | −55.7 (4) |
| C34—Fe2—C32—C36 | −81.2 (3) | C27—Fe2—C36—C32 | −89.7 (2) |
| C33—Fe2—C32—C36 | −119.5 (3) | C28—Fe2—C36—C32 | −133.5 (2) |
| C35—Fe2—C32—C36 | −38.0 (2) | C29—Fe2—C36—C32 | −171.7 (2) |
| C31—Fe2—C32—C36 | 149.1 (2) | C32—Fe2—C36—C35 | −118.9 (4) |
| C27—Fe2—C32—C36 | 106.0 (2) | C34—Fe2—C36—C35 | −37.5 (2) |
| C28—Fe2—C32—C36 | 66.7 (3) | C33—Fe2—C36—C35 | −81.5 (3) |
| C30—Fe2—C32—C36 | −176.0 (2) | C31—Fe2—C36—C35 | −174.7 (2) |
| C36—Fe2—C32—C33 | 119.5 (3) | C27—Fe2—C36—C35 | 151.3 (2) |
| C34—Fe2—C32—C33 | 38.3 (2) | C28—Fe2—C36—C35 | 107.6 (2) |
| C35—Fe2—C32—C33 | 81.5 (2) | C29—Fe2—C36—C35 | 69.3 (3) |
| C31—Fe2—C32—C33 | −91.4 (2) | C24—C23—C22—C21 | −0.2 (4) |
| C27—Fe2—C32—C33 | −134.5 (2) | Fe1—C23—C22—C21 | −60.0 (2) |
| C28—Fe2—C32—C33 | −173.7 (2) | C24—C23—C22—Fe1 | 59.8 (3) |
| C30—Fe2—C32—C33 | −56.5 (3) | C25—C21—C22—C23 | 0.2 (4) |
| C7—C6—C5—C4 | −1.0 (5) | Fe1—C21—C22—C23 | 61.3 (3) |
| C3—C4—C5—C6 | 0.0 (5) | C25—C21—C22—Fe1 | −61.1 (2) |
| C28—C29—C30—C31 | 0.4 (3) | C21—Fe1—C22—C23 | −116.9 (3) |
| Fe2—C29—C30—C31 | −59.20 (19) | C25—Fe1—C22—C23 | −77.3 (2) |
| C28—C29—C30—Fe2 | 59.56 (19) | C18—Fe1—C22—C23 | 80.2 (3) |
| C27—C31—C30—C29 | 0.3 (3) | C20—Fe1—C22—C23 | −158.3 (5) |
| Fe2—C31—C30—C29 | 59.5 (2) | C19—Fe1—C22—C23 | 44.1 (4) |
| C27—C31—C30—Fe2 | −59.16 (17) | C24—Fe1—C22—C23 | −35.0 (2) |
| C32—Fe2—C30—C29 | −171.3 (3) | C17—Fe1—C22—C23 | 123.9 (2) |
| C34—Fe2—C30—C29 | 107.1 (2) | C16—Fe1—C22—C23 | 165.4 (2) |
| C33—Fe2—C30—C29 | 151.32 (19) | C25—Fe1—C22—C21 | 39.7 (2) |
| C35—Fe2—C30—C29 | 66.9 (3) | C18—Fe1—C22—C21 | −162.8 (2) |
| C31—Fe2—C30—C29 | −119.1 (3) | C23—Fe1—C22—C21 | 116.9 (3) |
| C27—Fe2—C30—C29 | −81.71 (18) | C20—Fe1—C22—C21 | −41.3 (7) |
| C28—Fe2—C30—C29 | −37.36 (16) | C19—Fe1—C22—C21 | 161.0 (3) |
| C32—Fe2—C30—C31 | −52.2 (3) | C24—Fe1—C22—C21 | 81.9 (2) |
| C34—Fe2—C30—C31 | −133.8 (2) | C17—Fe1—C22—C21 | −119.1 (2) |
| C33—Fe2—C30—C31 | −89.6 (2) | C16—Fe1—C22—C21 | −77.7 (3) |
| C35—Fe2—C30—C31 | −174.0 (2) |