| Formula |
C24H30N4O7S |
| IUPAC Name |
(2s)-2-[[5-[4-[dimethylamino(dihydroxy)-$l^{4}-sulfanyl]phenyl]-8-methyl-2-oxo-7,9-dihydro-6h-pyrrolo[3,2-h]isoquinolin-3-yl]amino]oxy-4-hydroxybutanoic acid |
| Molecular Mass |
518.583 g·mol−1 |
| Heat of Formation |
-801.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.59 ± 1.08 D |
| Volume |
591.14 Å 3 |
| Surface Area |
497.9 Å 2 |
| HOMO Energy |
-8.56 ± 0.55 eV |
| LUMO Energy |
-1.10 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-({[(3e)-5-{4-[(dimethylamino)(dihydroxy)-lambda~4~-sulfanyl]phenyl}-8-methyl-2-oxo-6,7,8,9-tetrahydro-1h-pyrrolo[3,2-h]isoquinolin-3(2h)-ylidene]amino}oxy)-4-hydroxybutanoic acid
- m1l
|
| InChIKey |
PHWIDOUZQOKACD-FQEVSTJZSA-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
S
O
N
|
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