Formula |
C18H12N4 |
IUPAC Name |
4-[(4-cyanophenyl)-(4h-imidazol-3-ium-4-ylium-3-yl)methyl]benzonitrile |
Molecular Mass |
284.315 g·mol−1 |
Heat of Formation |
621.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.59 ± 1.08 D |
Volume |
349.25 Å 3 |
Surface Area |
311.94 Å 2 |
HOMO Energy |
-9.76 ± 0.55 eV |
LUMO Energy |
-1.40 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 4-[(4-cyanophenyl)-(1-imidazolyl)methyl]benzonitrile
- 4-[(4-cyanophenyl)-imidazol-1-yl-methyl]benzonitrile
- 4-[(4-cyanophenyl)-imidazol-1-ylmethyl]benzonitrile
|
InChIKey |
NRXVWQIGPASRKU-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
N
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