| Formula |
C27H31N5O2S |
| IUPAC Name |
1-[4-(2-benzyloxyethyl)thiazol-2-yl]-3-[5-tert-butyl-2-(p-tolyl)pyrazol-2-ium-5-ylium-3-yl]urea |
| Molecular Mass |
489.632 g·mol−1 |
| Heat of Formation |
100.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.18 ± 1.08 D |
| Volume |
597.65 Å 3 |
| Surface Area |
533.01 Å 2 |
| HOMO Energy |
-8.80 ± 0.55 eV |
| LUMO Energy |
2.38 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
MZGQVTBIULKWER-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
S
O
N
|
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