| Formula |
C28H28N4O4 |
| IUPAC Name |
1-[(1r)-1-(3-ethoxyphenyl)propyl]-7-(pyrimidin-5-ylmethoxy)-4,5-dihydrobenzo[g]indazole-3-carboxylic acid |
| Molecular Mass |
484.546 g·mol−1 |
| Heat of Formation |
-228.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.93 ± 1.08 D |
| Volume |
577.08 Å 3 |
| Surface Area |
472.0 Å 2 |
| HOMO Energy |
-8.66 ± 0.55 eV |
| LUMO Energy |
2.15 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
GEVQMCFWDDZLMU-RUZDIDTESA-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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