Formula |
C11H11N3S |
IUPAC Name |
2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1h-imidazole |
Molecular Mass |
217.290 g·mol−1 |
Heat of Formation |
322.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.90 ± 1.08 D |
Volume |
263.87 Å 3 |
Surface Area |
253.92 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
1.84 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1h-imidazole, 4,5-dihydro-2-((4-isothiocyanatophenyl)methyl)-
- 2-(4'-isothiocyanatobenzyl)imidazoline
- 2-[(4-isothiocyanatophenyl)methyl]-4,5-dihydro-1h-imidazole
- 2-ibi
- 4,5-dihydro-2-((4-isothiocyanatophenyl)methyl)-1h-imidazole
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CAS Number(s) |
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InChIKey |
RUXDSTKVMLGBTO-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
N
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