Formula |
C21H16IN3OS |
IUPAC Name |
4-[5-(3-iodophenyl)-2-[4-[(r)-methylsulfinyl]phenyl]-1h-imidazol-3-ium-5-id-4-yl]-3h-pyridin-1-ium-3-ide |
Molecular Mass |
485.341 g·mol−1 |
Heat of Formation |
415.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.05 ± 1.08 D |
Volume |
462.13 Å 3 |
Surface Area |
405.69 Å 2 |
HOMO Energy |
-8.77 ± 0.55 eV |
LUMO Energy |
1.94 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-[5-(3-iodo-phenyl)-2-(4-methanesulfinyl-phenyl)-1h-imidazol-4-yl]-pyridine
- 4-[5-(3-iodophenyl)-2-[4-[(r)-methylsulfinyl]phenyl]-3h-imidazol-4-yl]pyridine
- d13
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InChIKey |
RXDZANYWRNIAOR-HHHXNRCGSA-N |
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Links |
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Elements |
C
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