Formula |
C9H8N4O5 |
IUPAC Name |
(2s)-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid |
Molecular Mass |
252.184 g·mol−1 |
Heat of Formation |
-89.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.67 ± 1.08 D |
Volume |
261.85 Å 3 |
Surface Area |
247.29 Å 2 |
HOMO Energy |
-9.41 ± 0.55 eV |
LUMO Energy |
-2.39 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[(7-nitrobenzofurazan-4-yl)amino]propionic acid
- 4-(alpha-n-l-alanine)-7-nitrobenz-2-oxa-1,3-diazole
- l-alanine, n-(7-nitro-4-benzofurazanyl)-
- nitrobenzoxadiazolealanine
|
InChIKey |
KWAIYUDRTUOOPG-BYPYZUCNSA-N |
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Links |
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Downloads |
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Elements |
H
C
O
N
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