Formula |
C21H23NO3 |
IUPAC Name |
2-[(11z)-11-[3-(dimethylamino)propylidene]-6h-benzo[c][1]benzoxepin-2-yl]acetic acid |
Molecular Mass |
337.412 g·mol−1 |
Heat of Formation |
-327.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.03 ± 1.08 D |
Volume |
420.1 Å 3 |
Surface Area |
349.57 Å 2 |
HOMO Energy |
-8.59 ± 0.55 eV |
LUMO Energy |
-0.18 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 11-((z)-3-(dimethylamino)propylidene)-6,11-dihydrodibenz(b,e)oxepin-2-acetic acid
- 2-[(11z)-11-(3-dimethylaminopropylidene)-6h-benzo[c][2]benzoxepin-2-yl]acetic acid
- 2-[(11z)-11-(3-dimethylaminopropylidene)-6h-benzo[c][2]benzoxepin-2-yl]ethanoic acid
|
InChIKey |
JBIMVDZLSHOPLA-LSCVHKIXSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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