| Crystal data |
| Chemical formula |
[Ni(C6H4NO2)2(C16H38N6)] |
|
M
r
|
617.44 |
| Crystal system, space group |
Triclinic, P
|
| Temperature (K) |
100 |
|
a, b, c (Å) |
8.0630 (16), 8.5110 (17), 10.927 (2) |
| α, β, γ (°) |
80.52 (3), 88.26 (3), 86.44 (3) |
|
V (Å3) |
738.0 (3) |
|
Z
|
1 |
| Radiation type |
Synchrotron, λ = 0.62998 Å |
| μ (mm−1) |
0.51 |
| Crystal size (mm) |
0.01 × 0.004 × 0.004 |
| |
| Data collection |
| Diffractometer |
ADSC Q210 CCD area detector |
| Absorption correction |
Empirical (HKL-3000SM SCALEPACK; Otwinowski & Minor, 1997 ▸) |
|
T
min, T
max
|
0.995, 0.998 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
7634, 3879, 3326 |
|
R
int
|
0.023 |
| (sin θ/λ)max (Å−1) |
0.696 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.040, 0.110, 1.04 |
| No. of reflections |
3879 |
| No. of parameters |
188 |
| H-atom treatment |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
1.12, −0.95 |
