Formula |
C18H20N2O7S |
IUPAC Name |
(1r,2s)-6-hydroxy-7-methoxy-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1h-isoquinoline-1-carbohydroxamic acid |
Molecular Mass |
408.426 g·mol−1 |
Heat of Formation |
-866.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.44 ± 1.08 D |
Volume |
443.52 Å 3 |
Surface Area |
376.11 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
2.63 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (1r)-6-hydroxy-7-methoxy-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1h-isoquinoline-1-carbohydroxamic acid
- (1r)-n,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1h-isoquinoline-1-carboxamide
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InChIKey |
AYFCYVLVRYQGME-QGZVFWFLSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
S
O
N
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