Formula |
C24H24N2O3 |
IUPAC Name |
(2z)-7-(azepan-1-ium-1-ylmethyl)-2-(1h-indol-3-ylmethylene)-3-oxo-benzofuran-6-olate |
Molecular Mass |
388.459 g·mol−1 |
Heat of Formation |
-182.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.81 ± 1.08 D |
Volume |
462.07 Å 3 |
Surface Area |
395.97 Å 2 |
HOMO Energy |
-8.38 ± 0.55 eV |
LUMO Energy |
2.15 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- (2z)-7-(1-azepanylmethyl)-6-hydroxy-2-(1h-indol-3-ylmethylene)-3-benzofuranone
- (2z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-(1h-indol-3-ylmethylene)benzofuran-3-one
- (2z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-(1h-indol-3-ylmethylidene)-1-benzofuran-3-one
|
InChIKey |
IARYZBOIUVHJGF-XKZIYDEJSA-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
N
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