| Formula |
C23H24ClN3O2 |
| IUPAC Name |
3-chloro-4-[4-[(1s)-4-(2-pyridyl)-3,6-dihydro-2h-pyridin-1-yl]butyl]-1,4-benzoxazepin-5-one |
| Molecular Mass |
409.909 g·mol−1 |
| Heat of Formation |
24.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.72 ± 1.08 D |
| Volume |
477.44 Å 3 |
| Surface Area |
423.36 Å 2 |
| HOMO Energy |
-8.76 ± 0.55 eV |
| LUMO Energy |
-0.83 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 3-chloro-4-[4-(4-pyridin-2-yl-3,6-dihydro-2h-pyridin-1-yl)butyl]-1,4-benzoxazepin-5-one
- 3-chloro-4-[4-[4-(2-pyridyl)-3,6-dihydro-2h-pyridin-1-yl]butyl]-1,4-benzoxazepin-5-one
|
| InChIKey |
URMTUEWUIGOJBW-UHFFFAOYSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
Cl
|
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