| Formula |
C23H25ClN6S |
| IUPAC Name |
9-chloro-2-[[5-[3-(dimethylamino)propyl]-2-methyl-3-pyridyl]amino]-5,7-dihydropyrimido[5,4-d][1]benzazepine-6-thione |
| Molecular Mass |
453.003 g·mol−1 |
| Heat of Formation |
384.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.81 ± 1.08 D |
| Volume |
534.75 Å 3 |
| Surface Area |
473.07 Å 2 |
| HOMO Energy |
-8.71 ± 0.55 eV |
| LUMO Energy |
1.63 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MYVQSDVXBZNNLF-UHFFFAOYSA-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
N
S
Cl
|
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