| Formula |
C22H19ClN2O3S |
| IUPAC Name |
8-acetamido-n-(2-chlorophenyl)-n-methyl-4,5-dihydrothieno[3,2-d][1]benzoxepine-2-carboxamide |
| Molecular Mass |
426.916 g·mol−1 |
| Heat of Formation |
-260.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.39 ± 1.08 D |
| Volume |
468.0 Å 3 |
| Surface Area |
398.61 Å 2 |
| HOMO Energy |
-8.59 ± 0.55 eV |
| LUMO Energy |
2.14 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
RTUHEKLMDKJAQG-UHFFFAOYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
|
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