Formula |
C18H21N5O2S |
IUPAC Name |
4-(3-isopropyl-2-methyl-imidazol-3-ium-4-ylium-4-yl)-n-(4-methylsulfonylphenyl)pyrimidin-2-amine |
Molecular Mass |
371.457 g·mol−1 |
Heat of Formation |
-27.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.62 ± 1.08 D |
Volume |
439.29 Å 3 |
Surface Area |
359.4 Å 2 |
HOMO Energy |
-9.13 ± 0.55 eV |
LUMO Energy |
-0.97 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-(2-methyl-3-propan-2-yl-imidazol-4-yl)-n-(4-methylsulfonylphenyl)pyrimidin-2-amine
- 4-(2-methyl-3-propan-2-ylimidazol-4-yl)-n-(4-methylsulfonylphenyl)pyrimidin-2-amine
- 4-(3-isopropyl-2-methyl-4-imidazolyl)-n-(4-methylsulfonylphenyl)-2-pyrimidinamine
- 4-(3-isopropyl-2-methyl-imidazol-4-yl)-n-(4-methylsulfonylphenyl)pyrimidin-2-amine
- [4-(3-isopropyl-2-methyl-imidazol-4-yl)pyrimidin-2-yl]-(4-mesylphenyl)amine
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InChIKey |
WJRRGYBTGDJBFX-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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