| Formula |
C22H20ClN3O3S |
| IUPAC Name |
5-chloro-n-[(1r,2s)-2-[[4-(2-oxo-3h-pyridin-1-ium-3-id-1-yl)benzoyl]amino]cyclopentyl]thiophen-1-ium-5-ylium-2-carboxamide |
| Molecular Mass |
441.931 g·mol−1 |
| Heat of Formation |
-249.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.46 ± 1.08 D |
| Volume |
494.67 Å 3 |
| Surface Area |
402.18 Å 2 |
| HOMO Energy |
-9.19 ± 0.55 eV |
| LUMO Energy |
2.12 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
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| InChIKey |
QCPYHSAHOYXXQK-DLBZAZTESA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
|
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