| Crystal data |
| Chemical formula |
[Co(C16H14N2O2)(NO2)(C5H5N)] |
[Co(C16H14N2O2)(NO2)(C6H7N)] |
|
M
r
|
450.33 |
464.36 |
| Crystal system, space group |
Orthorhombic, P212121
|
Monoclinic, P21/c
|
| Temperature (K) |
302 |
301 |
|
a, b, c (Å) |
6.924 (2), 14.007 (3), 40.339 (8) |
9.7430 (4), 18.0136 (6), 12.8488 (5) |
| α, β, γ (°) |
90, 90, 90 |
90, 106.476 (1), 90 |
|
V (Å3) |
3912.3 (16) |
2162.45 (14) |
|
Z
|
8 |
4 |
| Radiation type |
Mo Kα |
Mo Kα |
| μ (mm−1) |
0.91 |
0.83 |
| Crystal size (mm) |
0.29 × 0.06 × 0.04 |
0.30 × 0.10 × 0.07 |
| |
| Data collection |
| Diffractometer |
Bruker D8 VENTURE |
Bruker D8 VENTURE |
| Absorption correction |
Integration (SADABS; Bruker, 2016 ▸) |
Integration (SADABS; Bruker, 2016 ▸) |
|
T
min, T
max
|
0.841, 0.965 |
0.847, 0.952 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
52512, 9036, 6955 |
23719, 5114, 3793 |
|
R
int
|
0.057 |
0.034 |
| (sin θ/λ)max (Å−1) |
0.656 |
0.659 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.034, 0.081, 1.11 |
0.055, 0.192, 1.08 |
| No. of reflections |
9036 |
5114 |
| No. of parameters |
541 |
281 |
| H-atom treatment |
H-atom parameters constrained |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.41, −0.38 |
1.25, −0.61 |
| Absolute structure |
Flack x determined using 2597 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al., 2013 ▸) |
– |
| Absolute structure parameter |
−0.010 (6) |
– |
