| Formula |
C22H32N8O3S |
| IUPAC Name |
(2s,4s)-n-ethyl-4-[[(2s)-2-(methylamino)-3-[1-[2-[(4-sulfanylbenzoyl)amino]ethyl]-2-aza-1-azonia-3-azanidacyclopenta-1,4-dien-4-yl]propanoyl]amino]pyrrolidine-2-carboxamide |
| Molecular Mass |
488.606 g·mol−1 |
| Heat of Formation |
-257.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.84 ± 1.08 D |
| Volume |
595.95 Å 3 |
| Surface Area |
502.05 Å 2 |
| HOMO Energy |
-9.09 ± 0.55 eV |
| LUMO Energy |
-1.27 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
VTNMGGUGQYETGZ-SNRMKQJTSA-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
S
O
N
|
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