Formula |
C23H23Br2NO5 |
IUPAC Name |
2-[3,5-dibromo-4-[4-hydroxy-3-[(r)-hydroxy-(2-phenylethylamino)methyl]phenoxy]phenyl]ethane-1,1-diol |
Molecular Mass |
553.240 g·mol−1 |
Heat of Formation |
-658.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.10 ± 1.08 D |
Volume |
536.3 Å 3 |
Surface Area |
465.51 Å 2 |
HOMO Energy |
-8.71 ± 0.55 eV |
LUMO Energy |
-1.05 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
KIRQJXNQGZAKGR-HSZRJFAPSA-N |
QR Code |
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Elements |
H
C
Br
O
N
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