| Crystal data |
| Chemical formula |
C10H12N3O3S+C7H3N2O7
|
|
M
r
|
481.41 |
| Crystal system, space group |
Triclinic, P
|
| Temperature (K) |
296 |
|
a, b, c () |
8.5551(1), 10.5000(2), 12.7576(3) |
| , , () |
106.463(1), 100.913(1), 108.272(1) |
|
V (3) |
993.72(3) |
|
Z
|
2 |
| Radiation type |
Mo K
|
| (mm1) |
0.23 |
| Crystal size (mm) |
0.20 0.20 0.16 |
| |
| Data collection |
| Diffractometer |
Bruker Kappa APEXII CCD |
| Absorption correction |
Multi-scan (SADABS; Bruker, 2004 ▸) |
|
T
min, T
max
|
0.955, 0.964 |
| No. of measured, independent and observed [I > 2(I)] reflections |
24261, 6718, 4911 |
|
R
int
|
0.030 |
| (sin /)max (1) |
0.758 |
| |
| Refinement |
|
R[F
2 > 2(F
2)], wR(F
2), S
|
0.048, 0.139, 1.05 |
| No. of reflections |
6718 |
| No. of parameters |
301 |
| H-atom treatment |
H-atom parameters constrained |
|
max, min (e 3) |
0.40, 0.40 |
