Formula |
C15H18N2O3 |
IUPAC Name |
2-[2-(2-amino-2-oxo-ethyl)-5-propyl-indol-1-ium-7-yl]acetic acid |
Molecular Mass |
274.315 g·mol−1 |
Heat of Formation |
-544.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.13 ± 1.08 D |
Volume |
331.68 Å 3 |
Surface Area |
303.26 Å 2 |
HOMO Energy |
-8.45 ± 0.55 eV |
LUMO Energy |
-0.14 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2-carbamoylmethyl-5-propyl-octahydro-indol-7-yl)acetic acid
- 2-[2-(2-amino-2-keto-ethyl)-5-propyl-1h-indol-7-yl]acetic acid
- 2-[2-(2-amino-2-oxo-ethyl)-5-propyl-1h-indol-7-yl]acetic acid
- 2-[2-(2-amino-2-oxo-ethyl)-5-propyl-1h-indol-7-yl]ethanoic acid
- 2-[2-(2-amino-2-oxoethyl)-5-propyl-1h-indol-7-yl]acetic acid
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InChIKey |
OMLOGGCSARAIGZ-UHFFFAOYSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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