Formula |
C19H29N2O3+ |
IUPAC Name |
5-[[4-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]phenyl]amino]-5-oxopentanoic acid |
Molecular Mass |
333.445 g·mol−1 |
Heat of Formation |
2467.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.28 ± 1.08 D |
Volume |
379.0 Å 3 |
Surface Area |
341.61 Å 2 |
HOMO Energy |
-8.90 ± 0.55 eV |
LUMO Energy |
-2.34 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 5-[[4-[2-(1-methyl-1-piperidin-1-iumyl)ethyl]phenyl]amino]-5-oxopentanoic acid
- 5-[[4-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]phenyl]amino]-5-oxo-pentanoic acid
- 5-keto-5-[[4-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]phenyl]amino]valeric acid
- gep
- n-methyl-n-(para-glutaramidophenyl-ethyl)-piperidinium ion
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InChIKey |
OKJUVEGXNINONS-UHFFFAOYSA-O |
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Elements |
C
O
N
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