Formula |
C11H13N5O |
IUPAC Name |
n-[(e)-3-(2-aminoimidazol-3-ium-4-ylium-4-yl)allyl]pyrrol-1-ium-2-ylium-2-carboxamide |
Molecular Mass |
231.254 g·mol−1 |
Heat of Formation |
139.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.45 ± 1.08 D |
Volume |
274.69 Å 3 |
Surface Area |
270.7 Å 2 |
HOMO Energy |
-8.74 ± 0.55 eV |
LUMO Energy |
-0.32 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1h-pyrrole-2-carboxamide, n-(3-(2-amino-1h-imidazol-4-yl)-2-propenyl)-, (e)-
- n-(3-(2-imino-2,3-dihydro-1h-imidazol-4-yl)-2-propenyl)-1h-pyrrole-2-carboxamide
- n-[(e)-3-(2-amino-3h-imidazol-4-yl)prop-2-enyl]-1h-pyrrole-2-carboxamide
- n-[3-(2-amino-3h-imidazol-4-yl)prop-2-enyl]-1h-pyrrole-2-carboxamide
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CAS Number(s) |
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InChIKey |
PJKFCZYTTBYEHL-HNQUOIGGSA-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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