Formula |
C23H22N4O7 |
IUPAC Name |
(2s)-2-[[4-[(1s)-1-[(2-amino-4-oxo-quinazolin-1-ium-3-id-6-yl)methyl]-2-oxo-ethyl]benzoyl]amino]pentanedioic acid |
Molecular Mass |
466.443 g·mol−1 |
Heat of Formation |
-997.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
11.04 ± 1.08 D |
Volume |
535.71 Å 3 |
Surface Area |
443.25 Å 2 |
HOMO Energy |
-9.34 ± 0.55 eV |
LUMO Energy |
-0.77 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
QUTYGDYGQXUSRV-QAPCUYQASA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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