| Formula |
C25H27N3O6 |
| IUPAC Name |
3-[(2e)-2-[[3-(2-carboxyethyl)-4-methyl-5-[(e)-(3-methyl-5-oxo-4-vinyl-pyrrol-2-ylidene)methyl]pyrrol-1-ium-2-ylium-2-yl]methylene]-4-methyl-5-oxo-pyrrol-3-yl]propanoic acid |
| Molecular Mass |
465.498 g·mol−1 |
| Heat of Formation |
-841.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.15 ± 1.08 D |
| Volume |
564.71 Å 3 |
| Surface Area |
450.32 Å 2 |
| HOMO Energy |
-8.92 ± 0.55 eV |
| LUMO Energy |
-1.36 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 3-[2-[(e)-[3-(2-carboxyethyl)-4-methyl-5-oxo-2-pyrrolylidene]methyl]-4-methyl-5-[(e)-(3-methyl-5-oxo-4-vinyl-2-pyrrolylidene)methyl]-1h-pyrrol-3-yl]propanoic acid
- 3-[2-[(e)-[3-(2-carboxyethyl)-4-methyl-5-oxo-pyrrol-2-ylidene]methyl]-4-methyl-5-[(e)-(3-methyl-5-oxo-4-vinyl-pyrrol-2-ylidene)methyl]-1h-pyrrol-3-yl]propanoic acid
- 3-[2-[(e)-[3-(2-carboxyethyl)-4-methyl-5-oxo-pyrrol-2-ylidene]methyl]-5-[(e)-(4-ethenyl-3-methyl-5-oxo-pyrrol-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
- 3-[2-[(e)-[3-(2-carboxyethyl)-4-methyl-5-oxopyrrol-2-ylidene]methyl]-5-[(e)-(4-ethenyl-3-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
- 3-[2-[(e)-[3-(2-carboxyethyl)-5-keto-4-methyl-3-pyrrolin-2-ylidene]methyl]-5-[(e)-(5-keto-3-methyl-4-vinyl-3-pyrrolin-2-ylidene)methyl]-4-methyl-1h-pyrrol-3-yl]propionic acid
|
| InChIKey |
PMIYFUGIVLGYIZ-WOEXBRBNSA-N |
| QR Code |
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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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