Formula |
C18H36Cl2N4O2++ |
IUPAC Name |
1-chloro-3-[4-[2-[4-(3-chloro-2-oxo-propyl)-1-ethynyl-pyrazin-1-ium-1-yl]ethynyl]pyrazine-1,4-diium-1-yl]propan-2-one |
Molecular Mass |
411.410 g·mol−1 |
Heat of Formation |
4066.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.70 ± 1.08 D |
Volume |
417.8 Å 3 |
Surface Area |
388.01 Å 2 |
HOMO Energy |
-9.92 ± 0.55 eV |
LUMO Energy |
-4.41 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UVYDWIMQPVNRJN-QZTJIDSGSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
C
N
O
Cl
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