| Cd1—N4i | 2.2546 (13) | N5—H5B | 0.8900 |
| Cd1—N4 | 2.2547 (13) | N5—C9 | 1.473 (2) |
| Cd1—N1i | 2.5046 (14) | C8—C8iii | 1.512 (3) |
| Cd1—N1 | 2.5045 (14) | C8—H8A | 0.9700 |
| Cd1—N5i | 2.3981 (15) | C8—H8B | 0.9700 |
| Cd1—N5 | 2.3980 (15) | N2—C2 | 1.150 (2) |
| Fe1—N3 | 1.9976 (14) | C7—C7ii | 1.465 (4) |
| Fe1—N3ii | 1.9976 (14) | C7—C6 | 1.396 (3) |
| Fe1—C1ii | 1.8951 (16) | C3—H3 | 0.9300 |
| Fe1—C1 | 1.8950 (16) | C3—C4 | 1.380 (3) |
| Fe1—C2ii | 1.9362 (17) | C4—H4 | 0.9300 |
| Fe1—C2 | 1.9363 (17) | C4—C5 | 1.376 (3) |
| N4—H4A | 0.8900 | C9—C9i | 1.509 (4) |
| N4—H4B | 0.8900 | C9—H9A | 0.9700 |
| N4—C8 | 1.4681 (19) | C9—H9B | 0.9700 |
| N3—C7 | 1.354 (2) | C6—H6 | 0.9300 |
| N3—C3 | 1.343 (2) | C6—C5 | 1.370 (3) |
| N1—C1 | 1.163 (2) | C5—H5 | 0.9300 |
| N5—H5A | 0.8900 | O1—H1 | 0.865 (9) |
| N4i—Cd1—N4 | 156.82 (7) | C3—N3—C7 | 118.18 (15) |
| N4i—Cd1—N1i | 83.39 (5) | C1—N1—Cd1 | 135.03 (12) |
| N4i—Cd1—N1 | 83.56 (5) | Cd1—N5—H5A | 109.6 |
| N4—Cd1—N1 | 83.39 (5) | Cd1—N5—H5B | 109.6 |
| N4—Cd1—N1i | 83.56 (5) | H5A—N5—H5B | 108.1 |
| N4i—Cd1—N5 | 88.96 (5) | C9—N5—Cd1 | 110.25 (11) |
| N4—Cd1—N5i | 88.96 (5) | C9—N5—H5A | 109.6 |
| N4—Cd1—N5 | 109.92 (5) | C9—N5—H5B | 109.6 |
| N4i—Cd1—N5i | 109.91 (5) | N4—C8—C8iii | 111.91 (16) |
| N1—Cd1—N1i | 111.12 (7) | N4—C8—H8A | 109.2 |
| N5—Cd1—N1i | 157.20 (5) | N4—C8—H8B | 109.2 |
| N5i—Cd1—N1i | 89.20 (5) | C8iii—C8—H8A | 109.2 |
| N5i—Cd1—N1 | 157.20 (5) | C8iii—C8—H8B | 109.2 |
| N5—Cd1—N1 | 89.20 (5) | H8A—C8—H8B | 107.9 |
| N5—Cd1—N5i | 73.24 (7) | N1—C1—Fe1 | 178.15 (14) |
| N3—Fe1—N3ii | 80.69 (8) | N2—C2—Fe1 | 176.85 (16) |
| C1ii—Fe1—N3 | 94.13 (6) | N3—C7—C7ii | 114.47 (10) |
| C1—Fe1—N3ii | 94.12 (6) | N3—C7—C6 | 120.93 (18) |
| C1ii—Fe1—N3ii | 174.82 (6) | C6—C7—C7ii | 124.60 (13) |
| C1—Fe1—N3 | 174.81 (6) | N3—C3—H3 | 118.5 |
| C1—Fe1—C1ii | 91.06 (9) | N3—C3—C4 | 122.95 (19) |
| C1ii—Fe1—C2 | 92.07 (6) | C4—C3—H3 | 118.5 |
| C1—Fe1—C2 | 89.69 (7) | C3—C4—H4 | 120.5 |
| C1ii—Fe1—C2ii | 89.69 (7) | C5—C4—C3 | 119.0 (2) |
| C1—Fe1—C2ii | 92.07 (7) | C5—C4—H4 | 120.5 |
| C2ii—Fe1—N3ii | 90.11 (6) | N5—C9—C9i | 110.03 (14) |
| C2—Fe1—N3ii | 87.98 (6) | N5—C9—H9A | 109.7 |
| C2—Fe1—N3 | 90.11 (6) | N5—C9—H9B | 109.7 |
| C2ii—Fe1—N3 | 87.98 (6) | C9i—C9—H9A | 109.7 |
| C2ii—Fe1—C2 | 177.49 (9) | C9i—C9—H9B | 109.7 |
| Cd1—N4—H4A | 108.8 | H9A—C9—H9B | 108.2 |
| Cd1—N4—H4B | 108.8 | C7—C6—H6 | 120.0 |
| H4A—N4—H4B | 107.7 | C5—C6—C7 | 120.1 (2) |
| C8—N4—Cd1 | 113.68 (9) | C5—C6—H6 | 120.0 |
| C8—N4—H4A | 108.8 | C4—C5—H5 | 120.6 |
| C8—N4—H4B | 108.8 | C6—C5—C4 | 118.82 (19) |
| C7—N3—Fe1 | 115.19 (12) | C6—C5—H5 | 120.6 |
| C3—N3—Fe1 | 126.62 (12) | ||
| Cd1—N4—C8—C8iii | −178.38 (14) | C7—N3—C3—C4 | −1.2 (3) |
| Cd1—N5—C9—C9i | 43.1 (2) | C7ii—C7—C6—C5 | 179.9 (2) |
| Fe1—N3—C7—C7ii | 0.1 (2) | C7—C6—C5—C4 | −0.5 (4) |
| Fe1—N3—C7—C6 | −179.70 (15) | C3—N3—C7—C7ii | −179.03 (18) |
| Fe1—N3—C3—C4 | 179.74 (15) | C3—N3—C7—C6 | 1.2 (3) |
| N3—C7—C6—C5 | −0.3 (3) | C3—C4—C5—C6 | 0.4 (4) |
| N3—C3—C4—C5 | 0.4 (3) |