| Formula |
C12H13N3O3S |
| IUPAC Name |
1-methyl-2-[(4-methylsulfanylphenoxy)methyl]-5-nitro-imidazole |
| Molecular Mass |
279.315 g·mol−1 |
| Heat of Formation |
96.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.59 ± 1.08 D |
| Volume |
318.19 Å 3 |
| Surface Area |
297.35 Å 2 |
| HOMO Energy |
-8.46 ± 0.55 eV |
| LUMO Energy |
1.81 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-methyl-2-((p-(methylthio)phenoxy)methyl)-5-nitroimidazole
- 1-methyl-2-[(4-methylsulfanylphenoxy)methyl]-5-nitro-imidazole
- 1-methyl-2-[[4-(methylthio)phenoxy]methyl]-5-nitro-imidazole
- 1-methyl-2-[[4-(methylthio)phenoxy]methyl]-5-nitroimidazole
|
| CAS Number(s) |
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| InChIKey |
MIWWSGDADVMLTG-UHFFFAOYSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
N
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