Formula |
C18H14F3NO3 |
IUPAC Name |
3-hydroxy-4-(4-methoxyphenyl)-6-(trifluoromethyl)-1,5-dihydro-1-benzazepin-2-one |
Molecular Mass |
349.304 g·mol−1 |
Heat of Formation |
-921.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.10 ± 1.08 D |
Volume |
373.24 Å 3 |
Surface Area |
318.16 Å 2 |
HOMO Energy |
-8.66 ± 0.55 eV |
LUMO Energy |
-1.02 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2h-1-benzazepin-2-one, 1,5-dihydro-3-hydroxy-4-(4-methoxyphenyl)-6-(trifluoromethyl)-
- 4,5-dihydro-4-(4-methoxyphenyl)-6-(trifluoromethyl)-1h-benzazepin-2,3-dione
- sq 32425
- sq-32425
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CAS Number(s) |
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InChIKey |
VNVKGPFMRDBSEG-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
N
O
F
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