| Formula |
C8H9N3O4 |
| IUPAC Name |
4-[(2-nitroimidazol-1-ium-2-ylium-1-yl)methoxy]but-2-yn-1-ol |
| Molecular Mass |
211.175 g·mol−1 |
| Heat of Formation |
51.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.13 ± 1.08 D |
| Volume |
236.28 Å 3 |
| Surface Area |
233.67 Å 2 |
| HOMO Energy |
-10.38 ± 0.55 eV |
| LUMO Energy |
1.69 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-butyn-1-ol, 4-((2-nitro-1h-imidazol-1-yl)methoxy)-
- 4-[(2-nitro-1-imidazolyl)methoxy]but-2-yn-1-ol
- 4-[(2-nitroimidazol-1-yl)methoxy]but-2-yn-1-ol
- rk 29
- rk-29
|
| CAS Number(s) |
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| InChIKey |
OFASSPXTJKYRPT-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
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