| Formula |
C29H28BFN2O6S |
| IUPAC Name |
5-cyclopropyl-2-(4-fluorophenyl)-6-[2-[(3r)-1-hydroxy-3h-2,1-benzoxaborol-3-yl]ethyl-methylsulfonyl-amino]-n-methyl-benzofuran-3-carboxamide |
| Molecular Mass |
562.417 g·mol−1 |
| Heat of Formation |
-1050.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.80 ± 1.08 D |
| Volume |
633.18 Å 3 |
| Surface Area |
524.8 Å 2 |
| HOMO Energy |
-8.94 ± 0.55 eV |
| LUMO Energy |
-1.33 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
NPAMWFMDBHAIAJ-RUZDIDTESA-N |
| QR Code |
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| Links |
PubChem
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| DOI |
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| Downloads |
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|
| Elements |
C
B
F
H
O
N
S
|
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