| Formula |
C21H21ClN5O6+ |
| IUPAC Name |
(2s)-2-[[4-[[(2-amino-5-chloro-4-oxo-3h-quinazolin-1-ium-6-yl)amino]methyl]benzoyl]amino]pentanedioic acid |
| Molecular Mass |
474.874 g·mol−1 |
| Heat of Formation |
-850.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.91 ± 1.08 D |
| Volume |
512.65 Å 3 |
| Surface Area |
459.52 Å 2 |
| HOMO Energy |
-8.57 ± 0.55 eV |
| LUMO Energy |
2.06 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
GBFUWHPCXNMVFC-AWEZNQCLSA-O |
| QR Code |
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| Links |
ChemSpider
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| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
Cl
|
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