Formula |
C27H34N4O9 |
IUPAC Name |
(4s)-4-[[4-(1-carboxy-1-methyl-ethoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-pentanoic acid |
Molecular Mass |
558.580 g·mol−1 |
Heat of Formation |
-1530.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.32 ± 1.08 D |
Volume |
650.35 Å 3 |
Surface Area |
542.44 Å 2 |
HOMO Energy |
-9.68 ± 0.55 eV |
LUMO Energy |
-1.77 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MCBLPJPMVOVJCO-SFHVURJKSA-N |
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Links |
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Elements |
H
C
O
N
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