Formula |
C20H21FN4O2 |
IUPAC Name |
4-[4-(4-fluorophenyl)-5-(2-methoxy-5h-pyrimidine-1,3-diium-5-id-4-yl)imidazol-3-ium-5-id-1-yl]cyclohexanol |
Molecular Mass |
368.405 g·mol−1 |
Heat of Formation |
-223.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.96 ± 1.08 D |
Volume |
439.5 Å 3 |
Surface Area |
365.76 Å 2 |
HOMO Energy |
-9.10 ± 0.55 eV |
LUMO Energy |
-0.91 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZQUSFAUAYSEREK-WKILWMFISA-N |
QR Code |
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Links |
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Elements |
H
C
N
O
F
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