| Formula |
C33H36BrN3O6 |
| IUPAC Name |
[(r)-[4-[(2r)-3-(4-acetylanilino)-2-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-3-oxo-propyl]-2-bromo-phenyl]-phenyl-methyl] hydrogen carbonate |
| Molecular Mass |
650.559 g·mol−1 |
| Heat of Formation |
-890.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.88 ± 1.08 D |
| Volume |
728.19 Å 3 |
| Surface Area |
557.68 Å 2 |
| HOMO Energy |
-9.20 ± 0.55 eV |
| LUMO Energy |
-0.81 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
PNPVDEPWEIHHIX-RUPMJYSSSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
O
Br
N
|
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