| Formula |
C25H33Cl2N5O3S |
| IUPAC Name |
1-[5-tert-butyl-3-[4-[2-(dimethylamino)ethyl]-5-oxo-1,4-diazepane-1-carbonyl]-2-thienyl]-3-(2,3-dichlorophenyl)urea |
| Molecular Mass |
554.532 g·mol−1 |
| Heat of Formation |
-497.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.54 ± 1.08 D |
| Volume |
637.14 Å 3 |
| Surface Area |
535.5 Å 2 |
| HOMO Energy |
-8.79 ± 0.55 eV |
| LUMO Energy |
-1.12 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
SIUIQMQVKUUQQF-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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