Formula |
C9H10N2O4 |
IUPAC Name |
(3s)-3-azaniumyl-3-(2-nitrophenyl)propanoate |
Molecular Mass |
210.187 g·mol−1 |
Heat of Formation |
1336.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.79 ± 1.08 D |
Volume |
218.1 Å 3 |
Surface Area |
216.08 Å 2 |
HOMO Energy |
-10.96 ± 0.55 eV |
LUMO Energy |
-0.70 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (3s)-3-ammonio-3-(2-nitrophenyl)propanoate
- (3s)-3-ammonio-3-(2-nitrophenyl)propionate
- (3s)-3-azaniumyl-3-(2-nitrophenyl)propanoate
- zinc00161426
|
InChIKey |
XXBOYULKNZTOMN-ZETCQYMHSA-N |
QR Code |
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Links |
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|
DOI |
|
Downloads |
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|
Elements |
C
O
N
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