5-[(3As,4S,6Ar)-2-Oxo-1,3,3A,4,6,6A-Hexahydrothieno[3,4-D]Imidazol-4-Yl]-N-[4-[[2-Chloro-2-[(Z)-2,3-Dimethylpent-2-En-4-Ynyl]-3-Aza-1-Azonia-2Λ5-Iridacyclopent-2-Yl]Sulfonyl]Phenyl]Pentanamide; Methane
Properties
| Property | Value |
|---|---|
| Formula | C28H48ClIrN5O4S2+ |
| IUPAC Name | 5-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-n-[4-[[2-chloro-2-[(z)-2,3-dimethylpent-2-en-4-ynyl]-3-aza-1-azonia-2λ5-iridacyclopent-2-yl]sulfonyl]phenyl]pentanamide; methane |
| Molecular Mass | 810.512 g·mol−1 |
| Heat of Formation | -145.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.62 ± 1.08 D |
| Volume | 816.24 Å 3 |
| Surface Area | 612.94 Å 2 |
| HOMO Energy | -8.30 ± 0.55 eV |
| LUMO Energy | -1.13 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LJJKVYGNDNVIDM-DYKJULMGSA-M |
| QR Code | Generate QR Code |
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| Elements | C Cl H Ir O N S |