Formula |
C23H32BBr2N3O6 |
IUPAC Name |
[(1r)-4,4-dibromo-1-[[(2s)-1-[(2s)-2-(5-oxopentanoylamino)-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]butyl]boronic acid |
Molecular Mass |
617.136 g·mol−1 |
Heat of Formation |
-1321.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
10.45 ± 1.08 D |
Volume |
644.85 Å 3 |
Surface Area |
534.93 Å 2 |
HOMO Energy |
-9.38 ± 0.55 eV |
LUMO Energy |
2.66 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UBBUVYGQLRDKJX-FHWLQOOXSA-N |
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Links |
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Elements |
C
B
H
O
N
Br
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