Information card for entry 1557820
| Common name |
3,3',5,5'-Tetrakis(2,3-dihydroxypropylcarbamoy1)-2,2',4,4',6,6'-hexaiodo-N,N'- (2-hydroxypropane-1,3-diy)diacetanilide monohydrate iodixanol |
| Formula |
C35 H46 I6 N6 O16 |
| Calculated formula |
C35 I6 N6 O17.5 |
| Title of publication |
Molecular and Crystal Structure of Iodixanol, a New X-Ray Contrast Agent |
| Authors of publication |
Tonnesen, Lisbeth Ehnebom; Pedersen, Berit Fjartoft; Klaveness, Jo |
| Journal of publication |
Acta Chemica Scandinavica |
| Year of publication |
1995 |
| Journal volume |
49 |
| Pages of publication |
433 - 440 |
| a |
16.864 ± 0.003 Å |
| b |
18.164 ± 0.003 Å |
| c |
19.36 ± 0.004 Å |
| α |
95.68 ± 0.02° |
| β |
102.43 ± 0.02° |
| γ |
114.56 ± 0.01° |
| Cell volume |
5147.4 ± 1.9 Å3 |
| Ambient diffraction temperature |
138 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for significantly intense reflections |
0.068 |
| Weighted residual factors for significantly intense reflections |
0.165 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.1 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71069 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1557820.html
