Formula |
C26H38N6O2 |
IUPAC Name |
2-cyano-n-(5-cyano-2,4-dimethylene-hept-6-ynyl)-n'-[[2-[ethynyl(penta-1,3-diynyl)amino]ethynylamino]methyl]-3-oxo-prop-2-enamidine; formaldehyde |
Molecular Mass |
466.619 g·mol−1 |
Heat of Formation |
-212.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.59 ± 1.08 D |
Volume |
591.41 Å 3 |
Surface Area |
477.07 Å 2 |
HOMO Energy |
-8.62 ± 0.55 eV |
LUMO Energy |
2.98 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
PPANZCQXFYBGHN-JOCHJYFZSA-N |
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Elements |
H
C
O
N
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