| Formula |
C27H25ClN6O4 |
| IUPAC Name |
2-[4-[[(2s)-2-[3-[5-chloro-2-(3,4-diaza-1-azonia-2-azanidacyclopenta-3,5-dien-1-yl)phenyl]propanoylamino]-3-phenyl-propanoyl]amino]phenyl]acetic acid |
| Molecular Mass |
532.978 g·mol−1 |
| Heat of Formation |
-264.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.28 ± 1.08 D |
| Volume |
609.42 Å 3 |
| Surface Area |
484.96 Å 2 |
| HOMO Energy |
-8.78 ± 0.55 eV |
| LUMO Energy |
1.48 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
WNOHYEPACJOGFG-QHCPKHFHSA-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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