| Formula |
C25H29ClN6O4 |
| IUPAC Name |
methyl (z)-3-[(3-chloro-4h-indol-1-ium-4-id-7-yl)amino]-2-cyano-3-[[(3s)-2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]amino]prop-2-enoate |
| Molecular Mass |
512.989 g·mol−1 |
| Heat of Formation |
-477.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.68 ± 1.08 D |
| Volume |
586.57 Å 3 |
| Surface Area |
461.52 Å 2 |
| HOMO Energy |
-8.85 ± 0.55 eV |
| LUMO Energy |
2.25 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
QDGDCWKBZPDHTQ-UZXYXVAJSA-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
Cl
O
N
|
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