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Predict NMR spectrum
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| InChI: |
1S/C32H16N8.Mn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2 |
| InChIKey: |
ICIFYHOILPYQKB-UHFFFAOYSA-N |
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| H donor: |
0 |
| H acceptor: |
8 |
| Rotatable bond: |
0 |
| Stereocenter: |
0 |
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| cLogP: |
7.587 |
| cLogS: |
-11.127 |
| Polar surface: |
82.33 |
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